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

C13H15FN4O2 — CID 105384409

IUPAC3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1nccc(C(=O)Nc2cc(C)on2)c1F
InChIInChI=1S/C13H15FN4O2/c1-3-5-15-12-11(14)9(4-6-16-12)13(19)17-10-7-8(2)20-18-10/h4,6-7H,3,5H2,1-2H3,(H,15,16)(H,17,18,19)
InChIKeyQBGHIHSFFKGZSY-UHFFFAOYSA-N
MW278.29 g/mol
LogP2.59
Rot. Bonds5

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

3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide (PubChem CID 105384409) has the molecular formula C13H15FN4O2 and a molecular weight of 278.29 g/mol. Its IUPAC name is 3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide
PubChem CID105384409
Molecular FormulaC13H15FN4O2
Molecular Weight278.29 g/mol
Exact Mass278.12
IUPAC Name3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1nccc(C(=O)Nc2cc(C)on2)c1F
InChIInChI=1S/C13H15FN4O2/c1-3-5-15-12-11(14)9(4-6-16-12)13(19)17-10-7-8(2)20-18-10/h4,6-7H,3,5H2,1-2H3,(H,15,16)(H,17,18,19)
InChIKeyQBGHIHSFFKGZSY-UHFFFAOYSA-N
XLogP2.59
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.29
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-fluoro-N-(2-methyl-4-pyridinyl)-2-(propylamino)pyridine-4-carboxamide
CID 105386819
3-fluoro-N-(6-oxo-1H-pyridazin-3-yl)-2-(propylamino)pyridine-4-carboxamide
CID 105387666
3-fluoro-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-2-(propylamino)pyridine-4-carboxamide
CID 106408130
2-(ethylamino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 62166695
3-fluoro-N-hexan-3-yl-2-(propylamino)pyridine-4-carboxamide
CID 105385116
3-fluoro-2-(propylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CID 105384157
N-[2-(ethylamino)-2-oxoethyl]-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105384867
3-fluoro-2-[(5-methyl-1,2-oxazol-3-yl)methylamino]pyridine-4-carboxylic acid
CID 105382172
3-fluoro-N-(2-methylsulfinylethyl)-2-(propylamino)pyridine-4-carboxamide
CID 105387416
N-[4-(dimethylamino)butan-2-yl]-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105385716
3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide
CID 105385394
3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 115646253

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide (CID 105384409) is 3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide is CCCNc1nccc(C(=O)Nc2cc(C)on2)c1F.
What is the InChIKey of 3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide?
The InChIKey is QBGHIHSFFKGZSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN4O2/c1-3-5-15-12-11(14)9(4-6-16-12)13(19)17-10-7-8(2)20-18-10/h4,6-7H,3,5H2,1-2H3,(H,15,16)(H,17,18,19).
What are the key properties of 3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide?
3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide has a molecular weight of 278.29 g/mol, XLogP of 2.59, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-2-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105384409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).