(2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride

C15H30ClN3O — CID 119682228

IUPAC(2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride
SMILESCN(C)C1(CNC(=O)[C@@H]2CCCCN2)CCCCC1.Cl
InChIInChI=1S/C15H29N3O.ClH/c1-18(2)15(9-5-3-6-10-15)12-17-14(19)13-8-4-7-11-16-13;/h13,16H,3-12H2,1-2H3,(H,17,19);1H/t13-;/m0./s1
InChIKeyWHPRFZQRGUZNKJ-ZOWNYOTGSA-N
MW303.88 g/mol
LogP1.93
Rot. Bonds4

About (2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride

(2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride (PubChem CID 119682228) has the molecular formula C15H30ClN3O and a molecular weight of 303.88 g/mol. Its IUPAC name is (2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride
PubChem CID119682228
Molecular FormulaC15H30ClN3O
Molecular Weight303.88 g/mol
Exact Mass303.21
IUPAC Name(2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride
SMILESCN(C)C1(CNC(=O)[C@@H]2CCCCN2)CCCCC1.Cl
InChIInChI=1S/C15H29N3O.ClH/c1-18(2)15(9-5-3-6-10-15)12-17-14(19)13-8-4-7-11-16-13;/h13,16H,3-12H2,1-2H3,(H,17,19);1H/t13-;/m0./s1
InChIKeyWHPRFZQRGUZNKJ-ZOWNYOTGSA-N
XLogP1.93
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.88
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(dimethylamino)oxan-4-yl]methyl]pyrrolidine-2-carboxamide
CID 119885272
N-[[1-(dimethylcarbamoyl)cyclopentyl]methyl]piperidine-2-carboxamide;hydrochloride
CID 119325049
(2R)-N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]pyrrolidine-2-carboxamide
CID 103814097
N-[[1-(hydroxymethyl)cyclopentyl]methyl]piperidine-2-carboxamide
CID 113293938
(2S)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]piperidine-2-carboxamide
CID 104914457
N-[(1-propan-2-ylcyclopropyl)methyl]azocane-2-carboxamide
CID 114240294
(2S)-N-[(2-methyloxolan-2-yl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119782231
N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3-thiazolidine-4-carboxamide
CID 105417283
(2S)-N-[(1-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide
CID 63829240
N-[[1-(dimethylamino)cyclopentyl]methyl]-3-piperidin-2-ylpropanamide
CID 83110283
N-[[1-(dimethylamino)cyclohexyl]methyl]-2,5-dihydro-1H-pyrrole-2-carboxamide;dihydrochloride
CID 154912244
N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylpiperidine-3-carboxamide
CID 105418341

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride?
The IUPAC name of (2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride (CID 119682228) is (2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for (2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride is CN(C)C1(CNC(=O)[C@@H]2CCCCN2)CCCCC1.Cl.
What is the InChIKey of (2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride?
The InChIKey is WHPRFZQRGUZNKJ-ZOWNYOTGSA-N. The full InChI is InChI=1S/C15H29N3O.ClH/c1-18(2)15(9-5-3-6-10-15)12-17-14(19)13-8-4-7-11-16-13;/h13,16H,3-12H2,1-2H3,(H,17,19);1H/t13-;/m0./s1.
What are the key properties of (2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride?
(2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride has a molecular weight of 303.88 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[[1-(dimethylamino)cyclohexyl]methyl]piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119682228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).