N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide

C16H14N4O3 — CID 139005695

IUPACN-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
SMILESCc1ccn(C)c(=O)c1NC(=O)c1cc(-c2cccnc2)on1
InChIInChI=1S/C16H14N4O3/c1-10-5-7-20(2)16(22)14(10)18-15(21)12-8-13(23-19-12)11-4-3-6-17-9-11/h3-9H,1-2H3,(H,18,21)
InChIKeyHLVKQXNPMQGUCD-UHFFFAOYSA-N
MW310.31 g/mol
LogP2.00
Rot. Bonds3

About N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide

N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide (PubChem CID 139005695) has the molecular formula C16H14N4O3 and a molecular weight of 310.31 g/mol. Its IUPAC name is N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
PubChem CID139005695
Molecular FormulaC16H14N4O3
Molecular Weight310.31 g/mol
Exact Mass310.11
IUPAC NameN-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
SMILESCc1ccn(C)c(=O)c1NC(=O)c1cc(-c2cccnc2)on1
InChIInChI=1S/C16H14N4O3/c1-10-5-7-20(2)16(22)14(10)18-15(21)12-8-13(23-19-12)11-4-3-6-17-9-11/h3-9H,1-2H3,(H,18,21)
InChIKeyHLVKQXNPMQGUCD-UHFFFAOYSA-N
XLogP2.00
TPSA90.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.31
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methylphenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 52986112
N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 122302827
N-[3-(dimethylamino)-4-methylphenyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 53051794
5-pyridin-3-yl-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]-1,2-oxazole-3-carboxamide
CID 55699473
N-ethyl-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 170210039
N-(2,6-dimethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 3073010
N-(2-chloro-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 17253103
N-(2-methyl-1,3-benzoxazol-5-yl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 46491961
N-(4-anilinophenyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 47048043
N-[3-methyl-5-(trifluoromethyl)phenyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 119049246
5-pyridin-3-yl-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]-1,2-oxazole-3-carboxamide
CID 122301419
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 78884142

Frequently Asked Questions

What is the IUPAC name of N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide (CID 139005695) is N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide is Cc1ccn(C)c(=O)c1NC(=O)c1cc(-c2cccnc2)on1.
What is the InChIKey of N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide?
The InChIKey is HLVKQXNPMQGUCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O3/c1-10-5-7-20(2)16(22)14(10)18-15(21)12-8-13(23-19-12)11-4-3-6-17-9-11/h3-9H,1-2H3,(H,18,21).
What are the key properties of N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide?
N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide has a molecular weight of 310.31 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,4-dimethyl-2-oxo-3-pyridinyl)-5-pyridin-3-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 139005695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).