N- (Piperidin-4-yl) cyclohexanecarboxamide hydrochloride

CAT: 0926-RBA82326-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0926-RBA82326-01Size:100 mg

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CAS Number

41823-26-1

MDL Number

MFCD13689290

Smiles

C1CCC (CC1) C (=O) NC2CCNCC2.Cl

Molecular Formula

C12H23ClN2O

Molecular Weight

246.78 g/mol

Controlled

Chemical Information

N-(Piperidine-4-yl)cyclohexanecarboxamide hydrochloride

CAS Number	41823-26-1
PubChem CID	22591434
IUPAC Name	N-piperidin-4-ylcyclohexanecarboxamide;hydrochloride
Molecular Formula	C12H23ClN2O
Molecular Weight	246.78
Topological Polar Surface Area	41.1
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	16
Formal Charge	0
Complexity	206

SMILES

C1CCC(CC1)C(=O)NC2CCNCC2.Cl

InChI

InChI=1S/C12H22N2O.ClH/c15-12(10-4-2-1-3-5-10)14-11-6-8-13-9-7-11;/h10-11,13H,1-9H2,(H,14,15);1H

InChIKey

SMLSJWDRRZCQLU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 41823-26-1

CID: 22591434

Formula: C12H23ClN2O

MW: 246.78

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	246.78
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	246.1498911
Monoisotopic Mass	246.1498911
Topological Polar Surface Area	41.1 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	206
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	2
Compound Is Canonicalized	Yes

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