N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide

C16H22N2O2 — CID 74878818

IUPACN-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide
SMILESCN(CCCc1ccccc1)C(=O)C1CCC(=O)NC1
InChIInChI=1S/C16H22N2O2/c1-18(11-5-8-13-6-3-2-4-7-13)16(20)14-9-10-15(19)17-12-14/h2-4,6-7,14H,5,8-12H2,1H3,(H,17,19)
InChIKeySBLVCILMUNGQMT-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.60
Rot. Bonds5

About N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide

N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide (PubChem CID 74878818) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide
PubChem CID74878818
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide
SMILESCN(CCCc1ccccc1)C(=O)C1CCC(=O)NC1
InChIInChI=1S/C16H22N2O2/c1-18(11-5-8-13-6-3-2-4-7-13)16(20)14-9-10-15(19)17-12-14/h2-4,6-7,14H,5,8-12H2,1H3,(H,17,19)
InChIKeySBLVCILMUNGQMT-UHFFFAOYSA-N
XLogP1.60
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-N-methyl-6-oxopiperidine-3-carboxamide
CID 74464257
N-methyl-N-(3-phenylpropyl)piperidine-4-carboxamide
CID 43588756
N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide
CID 73420162
N-[(4-fluorophenyl)methyl]-N-methyl-6-oxopiperidine-3-carboxamide
CID 112728353
N-(3-hydroxybutyl)-N-methyl-6-oxopiperidine-3-carboxamide
CID 115691430
N-[(4-bromophenyl)methyl]-N-methyl-6-oxopiperidine-3-carboxamide
CID 112728718
N,2-dimethyl-N-(4-phenylbutyl)piperidine-4-carboxamide
CID 106739419
(3R)-N-methyl-6-oxo-N-(4-phenoxyphenyl)piperidine-3-carboxamide
CID 95292808
N-[3-(N-methylanilino)propyl]-6-oxopiperidine-3-carboxamide
CID 73419587
N-methyl-5-oxo-N-(2-phenylethyl)piperazine-2-carboxamide
CID 107435243
3-amino-N-methyl-N-(4-phenylbutyl)cyclopentane-1-carboxamide
CID 66009595
(3R)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-6-oxopiperidine-3-carboxamide
CID 94152365

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide?
The IUPAC name of N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide (CID 74878818) is N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide.
What is the SMILES notation for N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide?
The canonical SMILES for N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide is CN(CCCc1ccccc1)C(=O)C1CCC(=O)NC1.
What is the InChIKey of N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide?
The InChIKey is SBLVCILMUNGQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-18(11-5-8-13-6-3-2-4-7-13)16(20)14-9-10-15(19)17-12-14/h2-4,6-7,14H,5,8-12H2,1H3,(H,17,19).
What are the key properties of N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide?
N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide has a molecular weight of 274.36 g/mol, XLogP of 1.60, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide is sourced from PubChem (CID 74878818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).