1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide

C21H27N3O2 — CID 131943063

IUPAC1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide
SMILESCc1cc(C)n(C)c(=O)c1C(=O)Nc1ccccc1CN1CCCCC1
InChIInChI=1S/C21H27N3O2/c1-15-13-16(2)23(3)21(26)19(15)20(25)22-18-10-6-5-9-17(18)14-24-11-7-4-8-12-24/h5-6,9-10,13H,4,7-8,11-12,14H2,1-3H3,(H,22,25)
InChIKeyFZGCZVXFJCKVPO-UHFFFAOYSA-N
MW353.47 g/mol
LogP3.24
Rot. Bonds4

About 1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide

1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide (PubChem CID 131943063) has the molecular formula C21H27N3O2 and a molecular weight of 353.47 g/mol. Its IUPAC name is 1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide
PubChem CID131943063
Molecular FormulaC21H27N3O2
Molecular Weight353.47 g/mol
Exact Mass353.21
IUPAC Name1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide
SMILESCc1cc(C)n(C)c(=O)c1C(=O)Nc1ccccc1CN1CCCCC1
InChIInChI=1S/C21H27N3O2/c1-15-13-16(2)23(3)21(26)19(15)20(25)22-18-10-6-5-9-17(18)14-24-11-7-4-8-12-24/h5-6,9-10,13H,4,7-8,11-12,14H2,1-3H3,(H,22,25)
InChIKeyFZGCZVXFJCKVPO-UHFFFAOYSA-N
XLogP3.24
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(azepan-1-ylmethyl)phenyl]-1,6-dimethyl-2-oxopyridine-3-carboxamide
CID 46968682
1-ethyl-4,6-dimethyl-N-[2-(morpholin-4-ylmethyl)phenyl]-2-oxopyridine-3-carboxamide
CID 131905733
4-cyano-1-methyl-N-[2-(piperidin-1-ylmethyl)phenyl]pyrrole-2-carboxamide
CID 131912405
2,6-dimethyl-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-4-carboxamide
CID 131894977
1,4,6-trimethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 110860792
N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
CID 110864709
methyl 2-[(1,4,6-trimethyl-2-oxopyridine-3-carbonyl)amino]benzoate
CID 110861610
4,5-dimethyl-N-[2-(pyrrolidin-1-ylmethyl)phenyl]-1H-indole-2-carboxamide
CID 86963715
1-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-3-[2-(piperidin-1-ylmethyl)phenyl]urea
CID 72892403
1,4,6-trimethyl-2-oxo-N-(4-piperidin-1-ylphenyl)pyridine-3-carboxamide
CID 110862214
5-methyl-N-[2-(piperidin-1-ylmethyl)phenyl]-1-propylpyrazole-4-carboxamide
CID 46968234
N-(2,6-dimethylphenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
CID 110857573

Frequently Asked Questions

What is the IUPAC name of 1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide (CID 131943063) is 1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide is Cc1cc(C)n(C)c(=O)c1C(=O)Nc1ccccc1CN1CCCCC1.
What is the InChIKey of 1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide?
The InChIKey is FZGCZVXFJCKVPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O2/c1-15-13-16(2)23(3)21(26)19(15)20(25)22-18-10-6-5-9-17(18)14-24-11-7-4-8-12-24/h5-6,9-10,13H,4,7-8,11-12,14H2,1-3H3,(H,22,25).
What are the key properties of 1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide?
1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide has a molecular weight of 353.47 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,6-trimethyl-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 131943063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).