N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide

C16H18N4O3 — CID 108562435

IUPACN-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide
SMILESCc1cc(C(=O)N2CCC(NC(=O)c3ccncc3)CC2)no1
InChIInChI=1S/C16H18N4O3/c1-11-10-14(19-23-11)16(22)20-8-4-13(5-9-20)18-15(21)12-2-6-17-7-3-12/h2-3,6-7,10,13H,4-5,8-9H2,1H3,(H,18,21)
InChIKeyJTESAOKQPJQVQI-UHFFFAOYSA-N
MW314.34 g/mol
LogP1.41
Rot. Bonds3

About N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide

N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide (PubChem CID 108562435) has the molecular formula C16H18N4O3 and a molecular weight of 314.34 g/mol. Its IUPAC name is N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide
PubChem CID108562435
Molecular FormulaC16H18N4O3
Molecular Weight314.34 g/mol
Exact Mass314.14
IUPAC NameN-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide
SMILESCc1cc(C(=O)N2CCC(NC(=O)c3ccncc3)CC2)no1
InChIInChI=1S/C16H18N4O3/c1-11-10-14(19-23-11)16(22)20-8-4-13(5-9-20)18-15(21)12-2-6-17-7-3-12/h2-3,6-7,10,13H,4-5,8-9H2,1H3,(H,18,21)
InChIKeyJTESAOKQPJQVQI-UHFFFAOYSA-N
XLogP1.41
TPSA88.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]-4-phenylbenzamide
CID 108559387
N-[1-(pyridine-4-carbonyl)piperidin-4-yl]pyridine-4-carboxamide
CID 110821209
N-[1-(2,5-dimethylfuran-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide
CID 47067173
5-methyl-N-[1-(4-phenylbenzoyl)piperidin-4-yl]-1,2-oxazole-3-carboxamide
CID 47800468
N-[1-[(3-methyl-1,2-oxazol-5-yl)carbamoyl]piperidin-4-yl]pyridine-4-carboxamide
CID 167954950
N-[1-(2-methylbenzoyl)piperidin-4-yl]pyridine-4-carboxamide
CID 110820250
N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pentanamide
CID 108561888
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-5-methyl-1,2-oxazole-3-carboxamide
CID 47028354
N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]-5-methyl-1,2-oxazole-3-carboxamide
CID 108563814
(4-chloropiperidin-1-yl)-(5-methyl-1,2-oxazol-3-yl)methanone
CID 66155616
4-methyl-N-[1-(1-pyridin-4-ylpyrazole-4-carbonyl)piperidin-4-yl]benzamide
CID 154788476
(4-bromopiperidin-1-yl)-(5-methyl-1,2-oxazol-3-yl)methanone
CID 80662471

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide?
The IUPAC name of N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide (CID 108562435) is N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide.
What is the SMILES notation for N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide?
The canonical SMILES for N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide is Cc1cc(C(=O)N2CCC(NC(=O)c3ccncc3)CC2)no1.
What is the InChIKey of N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide?
The InChIKey is JTESAOKQPJQVQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O3/c1-11-10-14(19-23-11)16(22)20-8-4-13(5-9-20)18-15(21)12-2-6-17-7-3-12/h2-3,6-7,10,13H,4-5,8-9H2,1H3,(H,18,21).
What are the key properties of N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide?
N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide has a molecular weight of 314.34 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]pyridine-4-carboxamide is sourced from PubChem (CID 108562435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).