6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide

C12H11FN4O2 — CID 175915305

IUPAC6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide
SMILESCONC(=O)c1ccc(Nc2ccc(F)cn2)nc1
InChIInChI=1S/C12H11FN4O2/c1-19-17-12(18)8-2-4-10(14-6-8)16-11-5-3-9(13)7-15-11/h2-7H,1H3,(H,17,18)(H,14,15,16)
InChIKeyZGBWYYIWBLNKEM-UHFFFAOYSA-N
MW262.24 g/mol
LogP1.65
Rot. Bonds4

About 6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide

6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide (PubChem CID 175915305) has the molecular formula C12H11FN4O2 and a molecular weight of 262.24 g/mol. Its IUPAC name is 6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide
PubChem CID175915305
Molecular FormulaC12H11FN4O2
Molecular Weight262.24 g/mol
Exact Mass262.09
IUPAC Name6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide
SMILESCONC(=O)c1ccc(Nc2ccc(F)cn2)nc1
InChIInChI=1S/C12H11FN4O2/c1-19-17-12(18)8-2-4-10(14-6-8)16-11-5-3-9(13)7-15-11/h2-7H,1H3,(H,17,18)(H,14,15,16)
InChIKeyZGBWYYIWBLNKEM-UHFFFAOYSA-N
XLogP1.65
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.24
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-fluoro-N-(5-fluoro-2-pyridinyl)pyridin-2-amine
CID 135228039
N-(5-fluoro-2-pyridinyl)-6-(methylamino)pyridine-3-carboxamide
CID 65482281
6-(4-acetamidoanilino)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 109163310
N-ethoxy-6-[(2-methylpyrimidin-4-yl)amino]pyridine-3-carboxamide
CID 175745710
4-[[2-[(5-fluoro-2-pyridinyl)amino]-5-(methylcarbamoyl)-4-pyridinyl]amino]-3-methoxybenzoic acid
CID 90154018
methyl 2-[(5-fluoro-2-pyridinyl)amino]acetate
CID 61312351
4-amino-3-fluoro-N-(5-fluoro-2-pyridinyl)benzamide
CID 65481834
3,5-diamino-N-(5-fluoro-2-pyridinyl)benzamide
CID 65482634
6-[4-(diethylamino)anilino]-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 109163316
methyl 6-(5-carbamoyl-2-fluoroanilino)pyridine-3-carboxylate
CID 171913696
N-[6-(4-acetylanilino)-3-pyridinyl]-4-fluorobenzamide
CID 113020400
N-(5-fluoro-2-pyridinyl)-3-hydroxy-4-methylbenzamide
CID 65479688

Frequently Asked Questions

What is the IUPAC name of 6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide?
The IUPAC name of 6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide (CID 175915305) is 6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide.
What is the SMILES notation for 6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide?
The canonical SMILES for 6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide is CONC(=O)c1ccc(Nc2ccc(F)cn2)nc1.
What is the InChIKey of 6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide?
The InChIKey is ZGBWYYIWBLNKEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN4O2/c1-19-17-12(18)8-2-4-10(14-6-8)16-11-5-3-9(13)7-15-11/h2-7H,1H3,(H,17,18)(H,14,15,16).
What are the key properties of 6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide?
6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide has a molecular weight of 262.24 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-fluoro-2-pyridinyl)amino]-N-methoxypyridine-3-carboxamide is sourced from PubChem (CID 175915305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).