2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide

C8H6F2N6O — CID 105381449

IUPAC2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide
SMILESCn1nnc(NC(=O)c2ccnc(F)c2F)n1
InChIInChI=1S/C8H6F2N6O/c1-16-14-8(13-15-16)12-7(17)4-2-3-11-6(10)5(4)9/h2-3H,1H3,(H,12,14,17)
InChIKeyYDGQWTLPHFSYFW-UHFFFAOYSA-N
MW240.17 g/mol
LogP0.14
Rot. Bonds2

About 2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide

2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide (PubChem CID 105381449) has the molecular formula C8H6F2N6O and a molecular weight of 240.17 g/mol. Its IUPAC name is 2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide
PubChem CID105381449
Molecular FormulaC8H6F2N6O
Molecular Weight240.17 g/mol
Exact Mass240.06
IUPAC Name2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide
SMILESCn1nnc(NC(=O)c2ccnc(F)c2F)n1
InChIInChI=1S/C8H6F2N6O/c1-16-14-8(13-15-16)12-7(17)4-2-3-11-6(10)5(4)9/h2-3H,1H3,(H,12,14,17)
InChIKeyYDGQWTLPHFSYFW-UHFFFAOYSA-N
XLogP0.14
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.17
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

3-fluoro-2-(methylamino)-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide
CID 105387045
2-chloro-N-(2-methyltetrazol-5-yl)pyridine-3-carboxamide
CID 938393
2-bromo-N-(2-methyltetrazol-5-yl)benzamide
CID 953438
N-[4-(carbamoylamino)phenyl]-2,3-difluoropyridine-4-carboxamide
CID 105380731
2,3-difluoro-N-(4-methylphenyl)pyridine-4-carboxamide
CID 105380183
2,4-dihydroxy-N-(2-methyltetrazol-5-yl)benzamide
CID 107723429
N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380320
2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide
CID 105380291
N-(4-chlorophenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380159
1-hydrazinyl-N-(2-methyltetrazol-5-yl)isoquinoline-4-carboxamide
CID 106774275
2,3-difluoro-N-(3-propan-2-yl-1,2-oxazol-5-yl)pyridine-4-carboxamide
CID 105380929
N-(2,5-difluoro-4-methylphenyl)-2,3-difluoropyridine-4-carboxamide
CID 103585463

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide?
The IUPAC name of 2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide (CID 105381449) is 2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide?
The canonical SMILES for 2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide is Cn1nnc(NC(=O)c2ccnc(F)c2F)n1.
What is the InChIKey of 2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide?
The InChIKey is YDGQWTLPHFSYFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F2N6O/c1-16-14-8(13-15-16)12-7(17)4-2-3-11-6(10)5(4)9/h2-3H,1H3,(H,12,14,17).
What are the key properties of 2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide?
2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide has a molecular weight of 240.17 g/mol, XLogP of 0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-N-(2-methyltetrazol-5-yl)pyridine-4-carboxamide is sourced from PubChem (CID 105381449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).