4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride

C17H27ClN2O — CID 119424594

IUPAC4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride
SMILESCC(C)C(CC(=O)NC1CCCNC1)c1ccccc1.Cl
InChIInChI=1S/C17H26N2O.ClH/c1-13(2)16(14-7-4-3-5-8-14)11-17(20)19-15-9-6-10-18-12-15;/h3-5,7-8,13,15-16,18H,6,9-12H2,1-2H3,(H,19,20);1H
InChIKeyYWTVITSXYBQQAI-UHFFFAOYSA-N
MW310.87 g/mol
LogP3.11
Rot. Bonds5

About 4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride

4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride (PubChem CID 119424594) has the molecular formula C17H27ClN2O and a molecular weight of 310.87 g/mol. Its IUPAC name is 4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride.

Molecular Properties

Compound Name4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride
PubChem CID119424594
Molecular FormulaC17H27ClN2O
Molecular Weight310.87 g/mol
Exact Mass310.18
IUPAC Name4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride
SMILESCC(C)C(CC(=O)NC1CCCNC1)c1ccccc1.Cl
InChIInChI=1S/C17H26N2O.ClH/c1-13(2)16(14-7-4-3-5-8-14)11-17(20)19-15-9-6-10-18-12-15;/h3-5,7-8,13,15-16,18H,6,9-12H2,1-2H3,(H,19,20);1H
InChIKeyYWTVITSXYBQQAI-UHFFFAOYSA-N
XLogP3.11
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.87
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-methoxyphenyl)-N-piperidin-3-ylbutanamide;hydrochloride
CID 119427977
4-methyl-3-phenyl-N-(2-pyrrolidin-3-ylethyl)pentanamide;hydrochloride
CID 119533754
3,4-diphenyl-N-pyrrolidin-3-ylbutanamide
CID 119451866
N-(3-methyl-2-phenylbutyl)piperidine-3-carboxamide
CID 119294119
N-piperidin-3-ylbenzamide
CID 22017045
3-methyl-2-phenyl-N-pyrrolidin-3-ylbutanamide
CID 119449948
2-naphthalen-1-yl-N-piperidin-3-ylacetamide;hydrochloride
CID 119427587
(3S)-N-cyclopentyl-3-phenylbutanamide
CID 697485
N-[1-(2-phenylbutanoyl)piperidin-4-yl]-3-piperidin-3-ylbutanamide
CID 119763648
3-(carbamoylamino)-3-(2-methylphenyl)-N-piperidin-3-ylpropanamide
CID 119424459
2-(4-phenylcyclohexyl)-N-piperidin-3-ylacetamide;hydrochloride
CID 119427918
N-[2-(aminomethyl)cyclohexyl]-4-methyl-3-phenylpentanamide;hydrochloride
CID 119609450

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride?
The IUPAC name of 4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride (CID 119424594) is 4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride.
What is the SMILES notation for 4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride?
The canonical SMILES for 4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride is CC(C)C(CC(=O)NC1CCCNC1)c1ccccc1.Cl.
What is the InChIKey of 4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride?
The InChIKey is YWTVITSXYBQQAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O.ClH/c1-13(2)16(14-7-4-3-5-8-14)11-17(20)19-15-9-6-10-18-12-15;/h3-5,7-8,13,15-16,18H,6,9-12H2,1-2H3,(H,19,20);1H.
What are the key properties of 4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride?
4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride has a molecular weight of 310.87 g/mol, XLogP of 3.11, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride is sourced from PubChem (CID 119424594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).