5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide

C18H18N4O2 — CID 109243004

IUPAC5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2cncc(Nc3ccc(C)c(C)c3)c2)no1
InChIInChI=1S/C18H18N4O2/c1-11-4-5-15(6-12(11)2)20-16-8-14(9-19-10-16)18(23)21-17-7-13(3)24-22-17/h4-10,20H,1-3H3,(H,21,22,23)
InChIKeyKHFXBVGJTFENIW-UHFFFAOYSA-N
MW322.37 g/mol
LogP3.99
Rot. Bonds4

About 5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide

5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide (PubChem CID 109243004) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is 5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
PubChem CID109243004
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC Name5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2cncc(Nc3ccc(C)c(C)c3)c2)no1
InChIInChI=1S/C18H18N4O2/c1-11-4-5-15(6-12(11)2)20-16-8-14(9-19-10-16)18(23)21-17-7-13(3)24-22-17/h4-10,20H,1-3H3,(H,21,22,23)
InChIKeyKHFXBVGJTFENIW-UHFFFAOYSA-N
XLogP3.99
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(3,4-dimethylanilino)-N-(3,4-dimethylphenyl)pyridine-3-carboxamide
CID 109242892
5-(3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109246348
5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
CID 109198151
N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide
CID 109223552
N-(3,4-dimethylphenyl)-5-(4-methylanilino)pyridine-3-carboxamide
CID 109242104
5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109243974
5-(2-ethyl-6-methylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109243738
5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-(2-methylphenyl)pyridine-3-carboxamide
CID 109241732
5-(2-methoxyethylamino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109228004
N-(3-chloro-4-fluorophenyl)-5-(3,4-dimethylanilino)pyridine-3-carboxamide
CID 109242960
methyl 3-[[5-[(3,4-dimethylphenyl)carbamoyl]-3-pyridinyl]amino]benzoate
CID 109242927
5-(3,4-dimethylanilino)-N-(2-ethylphenyl)pyridine-3-carboxamide
CID 109242952

Frequently Asked Questions

What is the IUPAC name of 5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide?
The IUPAC name of 5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide (CID 109243004) is 5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide is Cc1cc(NC(=O)c2cncc(Nc3ccc(C)c(C)c3)c2)no1.
What is the InChIKey of 5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide?
The InChIKey is KHFXBVGJTFENIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-11-4-5-15(6-12(11)2)20-16-8-14(9-19-10-16)18(23)21-17-7-13(3)24-22-17/h4-10,20H,1-3H3,(H,21,22,23).
What are the key properties of 5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide?
5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide has a molecular weight of 322.37 g/mol, XLogP of 3.99, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 109243004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).