N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide

C20H23N3O3 — CID 78893022

IUPACN-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide
SMILESCc1ccc(C(=O)N2CCC(C(=O)NCc3ccccc3)CC2)c(=O)[nH]1
InChIInChI=1S/C20H23N3O3/c1-14-7-8-17(19(25)22-14)20(26)23-11-9-16(10-12-23)18(24)21-13-15-5-3-2-4-6-15/h2-8,16H,9-13H2,1H3,(H,21,24)(H,22,25)
InChIKeyJEKYYNGIDQIBNZ-UHFFFAOYSA-N
MW353.42 g/mol
LogP1.85
Rot. Bonds4

About N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide

N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide (PubChem CID 78893022) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide
PubChem CID78893022
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC NameN-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide
SMILESCc1ccc(C(=O)N2CCC(C(=O)NCc3ccccc3)CC2)c(=O)[nH]1
InChIInChI=1S/C20H23N3O3/c1-14-7-8-17(19(25)22-14)20(26)23-11-9-16(10-12-23)18(24)21-13-15-5-3-2-4-6-15/h2-8,16H,9-13H2,1H3,(H,21,24)(H,22,25)
InChIKeyJEKYYNGIDQIBNZ-UHFFFAOYSA-N
XLogP1.85
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-3-(4-phenylpiperidine-1-carbonyl)-1H-pyridin-2-one
CID 86768751
N-[(4-fluorophenyl)methyl]-1-(2-methylbenzoyl)piperidine-4-carboxamide
CID 7935481
6-methyl-2-oxo-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]-1H-pyridine-3-carboxamide
CID 78895539
N-[(4-chlorophenyl)methyl]-1-(2-methylbenzoyl)piperidine-4-carboxamide
CID 2920836
N-benzyl-1-(3,5-dichlorobenzoyl)piperidine-4-carboxamide
CID 41305444
N-[[4-(methoxymethyl)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 46415724
N-benzyl-1-(2-methoxypropanoyl)piperidine-4-carboxamide
CID 87024119
N-benzyl-1-(2-phenylpropanoyl)piperidine-4-carboxamide
CID 11035504
N-[(4-chlorophenyl)methyl]-1-(2-fluorobenzoyl)piperidine-4-carboxamide
CID 17019078
1-(3-aminopropanoyl)-N-benzylpiperidine-4-carboxamide;hydrochloride
CID 119273066
1-[4-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperazin-1-yl]-2-pyrrolidin-1-ylethane-1,2-dione
CID 55867890
N-[(4-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27396099

Frequently Asked Questions

What is the IUPAC name of N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide (CID 78893022) is N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide is Cc1ccc(C(=O)N2CCC(C(=O)NCc3ccccc3)CC2)c(=O)[nH]1.
What is the InChIKey of N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide?
The InChIKey is JEKYYNGIDQIBNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-14-7-8-17(19(25)22-14)20(26)23-11-9-16(10-12-23)18(24)21-13-15-5-3-2-4-6-15/h2-8,16H,9-13H2,1H3,(H,21,24)(H,22,25).
What are the key properties of N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide?
N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide has a molecular weight of 353.42 g/mol, XLogP of 1.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 78893022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).