Isonicotine

CAT: 0926-FI24687-05Size: 100 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0926-FI24687-05Size:100 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

92118-22-4

Synonyms

3- (1-Methyl-3-pyrrolidinyl) pyridine

MDL Number

MFCD00128935

Smiles

CN1CCC (C1) C2=CN=CC=C2

Molecular Formula

C10H14N2

Molecular Weight

162.23 g/mol

Controlled

Chemical Information

3-(1-Methyl-3-pyrrolidinyl)pyridine

CAS Number	92118-22-4
PubChem CID	545517
IUPAC Name	3-(1-methylpyrrolidin-3-yl)pyridine
Molecular Formula	C10H14N2
Molecular Weight	162.23
XLogP	1.1
Topological Polar Surface Area	16.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	147

SMILES

CN1CCC(C1)C2=CN=CC=C2

InChI

InChI=1S/C10H14N2/c1-12-6-4-10(8-12)9-3-2-5-11-7-9/h2-3,5,7,10H,4,6,8H2,1H3

InChIKey

UEIZUEWXLJOVLD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 92118-22-4

CID: 545517

Formula: C10H14N2

MW: 162.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.23
XLogP3	1.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	162.115698455
Monoisotopic Mass	162.115698455
Topological Polar Surface Area	16.1 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	147
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FI37886	Isonicotinic acid
LYB58151-01	2- (Difluoromethoxy) isonicotinic acid
ICA48117	Methyl 2- (hydroxymethyl) isonicotinate
UQB35319	2- (Cyclohexyloxy) isonicotinic acid
PLB63905-01	Methyl 2- (bromomethyl) isonicotinate
LDA64958-01	2- (Ethylamino) isonicotinic acid
GAC81814-01	2- (Difluoromethyl) Isonicotinic Acid
WYB17198-01	2- (Trifluoromethoxy) isonicotinic acid
BKB71753-01	2-Methylamino-isonicotinic acid
ECA22195	2-Acetylamino-isonicotinic acid

Catalog	Name
280526-01	Isonicotine
AR-N08610-01	Isonicotine-d3
I8957-52	Isonicotine (3- (1-Methyl-3-pyrrolidinyl) pyridine)
MBS6043761-01	Isonicotine (3-(1-Methyl-3-pyrrolidinyl)pyridine)