Rilmenidine

CAT: 1596-AR-R01596-03Size: 50 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-R01596-03Size:50 Units

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CAS Number

54187-04-1

Synonyms

N- (dicyclopropylmethyl) -4,5-dihydrooxazol-2-amine; S 3341-3; N- (Dicyclopropylmethyl) -4,5-dihydro-2-oxazolamine

Molecular Formula

C10H16N2O

Molecular Weight

180.25

API Name

Rilmenidine

Chemical Information

Rilmenidine

Rilmenidine is an isourea.

CAS Number	54187-04-1
PubChem CID	68712
IUPAC Name	N-(dicyclopropylmethyl)-4,5-dihydro-1,3-oxazol-2-amine
Molecular Formula	C10H16N2O
Molecular Weight	180.25
XLogP	1.2
Topological Polar Surface Area	33.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Heavy Atom Count	13
Formal Charge	0
Complexity	219

SMILES

C1CC1C(C2CC2)NC3=NCCO3

InChI

InChI=1S/C10H16N2O/c1-2-7(1)9(8-3-4-8)12-10-11-5-6-13-10/h7-9H,1-6H2,(H,11,12)

InChIKey

CQXADFVORZEARL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 54187-04-1

CID: 68712

Formula: C10H16N2O

MW: 180.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	180.25
XLogP3	1.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	180.126263138
Monoisotopic Mass	180.126263138
Topological Polar Surface Area	33.6 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	219
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes