1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide

C24H33N5O3 — CID 172667558

IUPAC1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
SMILESCc1ccn(C(C)CN(C)C)c(=O)c1C(=O)N1CCC(C(=O)NCc2ccccn2)CC1
InChIInChI=1S/C24H33N5O3/c1-17-8-14-29(18(2)16-27(3)4)24(32)21(17)23(31)28-12-9-19(10-13-28)22(30)26-15-20-7-5-6-11-25-20/h5-8,11,14,18-19H,9-10,12-13,15-16H2,1-4H3,(H,26,30)
InChIKeyGZSXKDRFLNQSII-UHFFFAOYSA-N
MW439.56 g/mol
LogP1.84
Rot. Bonds7

About 1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide

1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide (PubChem CID 172667558) has the molecular formula C24H33N5O3 and a molecular weight of 439.56 g/mol. Its IUPAC name is 1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
PubChem CID172667558
Molecular FormulaC24H33N5O3
Molecular Weight439.56 g/mol
Exact Mass439.26
IUPAC Name1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
SMILESCc1ccn(C(C)CN(C)C)c(=O)c1C(=O)N1CCC(C(=O)NCc2ccccn2)CC1
InChIInChI=1S/C24H33N5O3/c1-17-8-14-29(18(2)16-27(3)4)24(32)21(17)23(31)28-12-9-19(10-13-28)22(30)26-15-20-7-5-6-11-25-20/h5-8,11,14,18-19H,9-10,12-13,15-16H2,1-4H3,(H,26,30)
InChIKeyGZSXKDRFLNQSII-UHFFFAOYSA-N
XLogP1.84
TPSA87.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.56
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 70725617
1-(2-methoxybenzoyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 113004432
1-(3-methylbenzoyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 113004430
4-methyl-1-(1-phenylethyl)-3-[4-(pyridin-2-ylmethyl)piperazine-1-carbonyl]pyridin-2-one
CID 172657157
1-(4-chlorobenzoyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 3472038
1-(furan-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 35555974
1-N-cyclohexyl-4-N-(pyridin-2-ylmethyl)piperidine-1,4-dicarboxamide
CID 113004461
1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide
CID 172673669
1-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 46411181
N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride
CID 56832240
N-(pyridin-2-ylmethyl)-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide
CID 27554188
(3S)-1-[1-(pyridine-2-carbonyl)piperidin-4-yl]-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 96579721

Frequently Asked Questions

What is the IUPAC name of 1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide?
The IUPAC name of 1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide (CID 172667558) is 1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide is Cc1ccn(C(C)CN(C)C)c(=O)c1C(=O)N1CCC(C(=O)NCc2ccccn2)CC1.
What is the InChIKey of 1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide?
The InChIKey is GZSXKDRFLNQSII-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N5O3/c1-17-8-14-29(18(2)16-27(3)4)24(32)21(17)23(31)28-12-9-19(10-13-28)22(30)26-15-20-7-5-6-11-25-20/h5-8,11,14,18-19H,9-10,12-13,15-16H2,1-4H3,(H,26,30).
What are the key properties of 1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide?
1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide has a molecular weight of 439.56 g/mol, XLogP of 1.84, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide is sourced from PubChem (CID 172667558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).