(2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride

C17H29ClN2O — CID 120623102

IUPAC(2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride
SMILESC[C@H]1C[C@@H](C(=O)NC2CC3CC2C2CCCC32)CCN1.Cl
InChIInChI=1S/C17H28N2O.ClH/c1-10-7-11(5-6-18-10)17(20)19-16-9-12-8-15(16)14-4-2-3-13(12)14;/h10-16,18H,2-9H2,1H3,(H,19,20);1H/t10-,11-,12?,13?,14?,15?,16?;/m0./s1
InChIKeyXZKVAMLGLPLKRU-AOQBTDDTSA-N
MW312.89 g/mol
LogP2.74
Rot. Bonds2

About (2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride

(2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride (PubChem CID 120623102) has the molecular formula C17H29ClN2O and a molecular weight of 312.89 g/mol. Its IUPAC name is (2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride
PubChem CID120623102
Molecular FormulaC17H29ClN2O
Molecular Weight312.89 g/mol
Exact Mass312.20
IUPAC Name(2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride
SMILESC[C@H]1C[C@@H](C(=O)NC2CC3CC2C2CCCC32)CCN1.Cl
InChIInChI=1S/C17H28N2O.ClH/c1-10-7-11(5-6-18-10)17(20)19-16-9-12-8-15(16)14-4-2-3-13(12)14;/h10-16,18H,2-9H2,1H3,(H,19,20);1H/t10-,11-,12?,13?,14?,15?,16?;/m0./s1
InChIKeyXZKVAMLGLPLKRU-AOQBTDDTSA-N
XLogP2.74
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.89
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride with MolForge

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Related Compounds

(2S,4S)-N-(2-cyclohexylcyclopropyl)-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120636110
N-(8-tricyclo[5.2.1.02,6]decanyl)pyrrolidine-3-carboxamide
CID 63005281
N-[(1R,2S,6S,7S,8R)-8-tricyclo[5.2.1.02,6]decanyl]cyclopentanecarboxamide
CID 124785473
(3R)-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-3-carboxamide
CID 81124941
2-methyl-N-(2-methylsulfanylcyclopentyl)piperidine-4-carboxamide
CID 106832174
2-[(2-methylpiperidine-4-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 106740331
(2S,4S)-N-(2,4-dimethylcyclohexyl)-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120632807
cis-(1S,2R)-2-(8-tricyclo[5.2.1.02,6]decanylcarbamoyl)cyclopropane-1-carboxylic acid
CID 114091906
N-cyclohexyl-2-methylpiperidine-4-carboxamide
CID 106738484
N-(2-ethylcyclopropyl)-2-methylpiperidine-4-carboxamide
CID 106832165
(2S,4S)-2-methyl-N-(3-methylcyclobutyl)piperidine-4-carboxamide
CID 120633929
(2S,4S)-N-(3-carbamoylcyclohexyl)-2-methylpiperidine-4-carboxamide
CID 120628042

Frequently Asked Questions

What is the IUPAC name of (2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of (2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride (CID 120623102) is (2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for (2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for (2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride is C[C@H]1C[C@@H](C(=O)NC2CC3CC2C2CCCC32)CCN1.Cl.
What is the InChIKey of (2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is XZKVAMLGLPLKRU-AOQBTDDTSA-N. The full InChI is InChI=1S/C17H28N2O.ClH/c1-10-7-11(5-6-18-10)17(20)19-16-9-12-8-15(16)14-4-2-3-13(12)14;/h10-16,18H,2-9H2,1H3,(H,19,20);1H/t10-,11-,12?,13?,14?,15?,16?;/m0./s1.
What are the key properties of (2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride?
(2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride has a molecular weight of 312.89 g/mol, XLogP of 2.74, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4S)-2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 120623102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).