3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide

C9H10FN7O — CID 105387045

IUPAC3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide
SMILESCNc1nccc(C(=O)Nc2nnn(C)n2)c1F
InChIInChI=1S/C9H10FN7O/c1-11-7-6(10)5(3-4-12-7)8(18)13-9-14-16-17(2)15-9/h3-4H,1-2H3,(H,11,12)(H,13,15,18)
InChIKeyKYNOQWVIRUECBU-UHFFFAOYSA-N
MW251.22 g/mol
LogP0.04
Rot. Bonds3

About 3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide

3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide (PubChem CID 105387045) has the molecular formula C9H10FN7O and a molecular weight of 251.22 g/mol. Its IUPAC name is 3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide
PubChem CID105387045
Molecular FormulaC9H10FN7O
Molecular Weight251.22 g/mol
Exact Mass251.09
IUPAC Name3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide
SMILESCNc1nccc(C(=O)Nc2nnn(C)n2)c1F
InChIInChI=1S/C9H10FN7O/c1-11-7-6(10)5(3-4-12-7)8(18)13-9-14-16-17(2)15-9/h3-4H,1-2H3,(H,11,12)(H,13,15,18)
InChIKeyKYNOQWVIRUECBU-UHFFFAOYSA-N
XLogP0.04
TPSA97.62 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.22
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide
CID 105381449
3-fluoro-2-(methylamino)-N-(6-oxo-1H-pyridazin-3-yl)pyridine-4-carboxamide
CID 105387664
3-fluoro-2-(methylamino)-N-(2-propan-2-ylpyrazol-3-yl)pyridine-4-carboxamide
CID 105384065
3-fluoro-2-(methylamino)-N-(2,3,5-trifluorophenyl)pyridine-4-carboxamide
CID 105386062
2-chloro-N-(2-methyltetrazol-5-yl)pyridine-3-carboxamide
CID 938393
N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105385160
3-fluoro-2-(methylamino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide
CID 105384003
2,4-dihydroxy-N-(2-methyltetrazol-5-yl)benzamide
CID 107723429
N-(2,6-dichloro-4-fluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105387184
3-fluoro-N-(5-fluoro-2-methylphenyl)-2-(methylamino)pyridine-4-carboxamide
CID 105384530
3-fluoro-N-(2-fluoro-4-methylphenyl)-2-(methylamino)pyridine-4-carboxamide
CID 105383951
N-(2,3-dihydro-1H-inden-5-yl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105384126

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide (CID 105387045) is 3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide is CNc1nccc(C(=O)Nc2nnn(C)n2)c1F.
What is the InChIKey of 3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide?
The InChIKey is KYNOQWVIRUECBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN7O/c1-11-7-6(10)5(3-4-12-7)8(18)13-9-14-16-17(2)15-9/h3-4H,1-2H3,(H,11,12)(H,13,15,18).
What are the key properties of 3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide?
3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide has a molecular weight of 251.22 g/mol, XLogP of 0.04, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide is sourced from PubChem (CID 105387045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).