N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride

C13H25ClN2O2 — CID 110931002

IUPACN-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride
SMILESCC1(C(=O)NC2CCCCC2O)CCCNC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-13(7-4-8-14-9-13)12(17)15-10-5-2-3-6-11(10)16;/h10-11,14,16H,2-9H2,1H3,(H,15,17);1H
InChIKeyYSSSFSBDLNQCHJ-UHFFFAOYSA-N
MW276.81 g/mol
LogP1.22
Rot. Bonds2

About N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride

N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride (PubChem CID 110931002) has the molecular formula C13H25ClN2O2 and a molecular weight of 276.81 g/mol. Its IUPAC name is N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride
PubChem CID110931002
Molecular FormulaC13H25ClN2O2
Molecular Weight276.81 g/mol
Exact Mass276.16
IUPAC NameN-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride
SMILESCC1(C(=O)NC2CCCCC2O)CCCNC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-13(7-4-8-14-9-13)12(17)15-10-5-2-3-6-11(10)16;/h10-11,14,16H,2-9H2,1H3,(H,15,17);1H
InChIKeyYSSSFSBDLNQCHJ-UHFFFAOYSA-N
XLogP1.22
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.81
LogP ≤ 51.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylcyclopentane-1-carboxamide
CID 104927764
N-cyclohexyl-3-methylpiperidine-3-carboxamide
CID 63132420
4-[(3-methylpiperidine-3-carbonyl)amino]oxolane-3-carboxylic acid
CID 66240131
N-(2-ethylcyclohexyl)-3-methylpyrrolidine-3-carboxamide
CID 63139427
N-(3,3-dimethylcyclopentyl)-3-methylpiperidine-3-carboxamide
CID 115977020
3-methyl-N-(oxan-4-yl)piperidine-3-carboxamide
CID 63130240
1-methyl-2-[(3-methylpiperidine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 82763010
3-methyl-N-(1-methylpyrrolidin-3-yl)piperidine-3-carboxamide
CID 63135348
3-methylpiperidine-3-carbohydrazide
CID 63991806
(3R)-N-[(3R)-1,1-dioxothian-3-yl]-3-methylpiperidine-3-carboxamide
CID 129369661
N-[2-(cyclopropylamino)-2-oxoethyl]-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943977
(3S)-N-[(3S)-1,1-dioxothian-3-yl]-3-methylpiperidine-3-carboxamide
CID 129369662

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride (CID 110931002) is N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride is CC1(C(=O)NC2CCCCC2O)CCCNC1.Cl.
What is the InChIKey of N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride?
The InChIKey is YSSSFSBDLNQCHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2.ClH/c1-13(7-4-8-14-9-13)12(17)15-10-5-2-3-6-11(10)16;/h10-11,14,16H,2-9H2,1H3,(H,15,17);1H.
What are the key properties of N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride?
N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride has a molecular weight of 276.81 g/mol, XLogP of 1.22, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclohexyl)-3-methylpiperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 110931002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).