N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride

C18H22ClN3O2 — CID 120574114

IUPACN-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride
SMILESCC1NCCCC1NC(=O)c1ccc(-c2ccccc2)[nH]c1=O.Cl
InChIInChI=1S/C18H21N3O2.ClH/c1-12-15(8-5-11-19-12)20-17(22)14-9-10-16(21-18(14)23)13-6-3-2-4-7-13;/h2-4,6-7,9-10,12,15,19H,5,8,11H2,1H3,(H,20,22)(H,21,23);1H
InChIKeyWZRYWGZTBCCZPT-UHFFFAOYSA-N
MW347.85 g/mol
LogP2.33
Rot. Bonds3

About N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride

N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride (PubChem CID 120574114) has the molecular formula C18H22ClN3O2 and a molecular weight of 347.85 g/mol. Its IUPAC name is N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride
PubChem CID120574114
Molecular FormulaC18H22ClN3O2
Molecular Weight347.85 g/mol
Exact Mass347.14
IUPAC NameN-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride
SMILESCC1NCCCC1NC(=O)c1ccc(-c2ccccc2)[nH]c1=O.Cl
InChIInChI=1S/C18H21N3O2.ClH/c1-12-15(8-5-11-19-12)20-17(22)14-9-10-16(21-18(14)23)13-6-3-2-4-7-13;/h2-4,6-7,9-10,12,15,19H,5,8,11H2,1H3,(H,20,22)(H,21,23);1H
InChIKeyWZRYWGZTBCCZPT-UHFFFAOYSA-N
XLogP2.33
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.85
LogP ≤ 52.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 120574115
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N-(2-methylpiperidin-3-yl)-2-oxo-1H-quinoline-4-carboxamide
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N-(2-methylcyclohexyl)-6-naphthalen-2-yl-2-oxo-1H-pyridine-3-carboxamide
CID 66497320
2-benzyl-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride
CID 120573776
N-(2-methylpiperidin-3-yl)-2-phenylacetamide;hydrochloride
CID 120574528
N-[(3S)-oxan-3-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 129396964
2-benzyl-N-(2-methylpiperidin-3-yl)benzamide
CID 120573777
N-(2-methylpiperidin-3-yl)-4-(phenylcarbamoylamino)benzamide;hydrochloride
CID 120577264
2-(4-fluorobenzoyl)-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride
CID 120575467

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride (CID 120574114) is N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride is CC1NCCCC1NC(=O)c1ccc(-c2ccccc2)[nH]c1=O.Cl.
What is the InChIKey of N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride?
The InChIKey is WZRYWGZTBCCZPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2.ClH/c1-12-15(8-5-11-19-12)20-17(22)14-9-10-16(21-18(14)23)13-6-3-2-4-7-13;/h2-4,6-7,9-10,12,15,19H,5,8,11H2,1H3,(H,20,22)(H,21,23);1H.
What are the key properties of N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride?
N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride has a molecular weight of 347.85 g/mol, XLogP of 2.33, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpiperidin-3-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride is sourced from PubChem (CID 120574114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).