1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide

C19H24N4O3 — CID 70725617

IUPAC1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
SMILESCC(C)c1cc(C(=O)N2CCC(C(=O)NCc3ccccn3)CC2)no1
InChIInChI=1S/C19H24N4O3/c1-13(2)17-11-16(22-26-17)19(25)23-9-6-14(7-10-23)18(24)21-12-15-5-3-4-8-20-15/h3-5,8,11,13-14H,6-7,9-10,12H2,1-2H3,(H,21,24)
InChIKeyDMETXQMTSIOOJI-UHFFFAOYSA-N
MW356.43 g/mol
LogP2.36
Rot. Bonds5

About 1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide

1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide (PubChem CID 70725617) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is 1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
PubChem CID70725617
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC Name1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
SMILESCC(C)c1cc(C(=O)N2CCC(C(=O)NCc3ccccn3)CC2)no1
InChIInChI=1S/C19H24N4O3/c1-13(2)17-11-16(22-26-17)19(25)23-9-6-14(7-10-23)18(24)21-12-15-5-3-4-8-20-15/h3-5,8,11,13-14H,6-7,9-10,12H2,1-2H3,(H,21,24)
InChIKeyDMETXQMTSIOOJI-UHFFFAOYSA-N
XLogP2.36
TPSA88.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-methylbenzoyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 113004430
1-(furan-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 35555974
[4-[hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-(5-propan-2-yl-1,2-oxazol-3-yl)methanone
CID 70704336
1-(4-chlorobenzoyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 3472038
1-(2-methoxybenzoyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 113004432
1-N-cyclohexyl-4-N-(pyridin-2-ylmethyl)piperidine-1,4-dicarboxamide
CID 113004461
1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 172667558
(3S)-1-[1-(pyridine-2-carbonyl)piperidin-4-yl]-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 96579721
4-N-cyclopropyl-1-N-(pyridin-2-ylmethyl)cyclohexane-1,4-dicarboxamide
CID 109144683
1-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 46411181
1-[3-(2-methylpyrazol-3-yl)propanoyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 77084514
N-(pyridin-2-ylmethyl)piperidine-4-carboxamide;hydrochloride
CID 56832240

Frequently Asked Questions

What is the IUPAC name of 1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide (CID 70725617) is 1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide is CC(C)c1cc(C(=O)N2CCC(C(=O)NCc3ccccn3)CC2)no1.
What is the InChIKey of 1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide?
The InChIKey is DMETXQMTSIOOJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-13(2)17-11-16(22-26-17)19(25)23-9-6-14(7-10-23)18(24)21-12-15-5-3-4-8-20-15/h3-5,8,11,13-14H,6-7,9-10,12H2,1-2H3,(H,21,24).
What are the key properties of 1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide?
1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide has a molecular weight of 356.43 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-propan-2-yl-1,2-oxazole-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide is sourced from PubChem (CID 70725617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).