3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide

C7H4F4N2O — CID 118807178

IUPAC3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide
SMILESNC(=O)c1ncc(F)c(F)c1C(F)F
InChIInChI=1S/C7H4F4N2O/c8-2-1-13-5(7(12)14)3(4(2)9)6(10)11/h1,6H,(H2,12,14)
InChIKeyPUTNXCUQAPNRCU-UHFFFAOYSA-N
MW208.11 g/mol
LogP1.40
Rot. Bonds2

About 3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide

3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide (PubChem CID 118807178) has the molecular formula C7H4F4N2O and a molecular weight of 208.11 g/mol. Its IUPAC name is 3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide.

Molecular Properties

Compound Name3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide
PubChem CID118807178
Molecular FormulaC7H4F4N2O
Molecular Weight208.11 g/mol
Exact Mass208.03
IUPAC Name3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide
SMILESNC(=O)c1ncc(F)c(F)c1C(F)F
InChIInChI=1S/C7H4F4N2O/c8-2-1-13-5(7(12)14)3(4(2)9)6(10)11/h1,6H,(H2,12,14)
InChIKeyPUTNXCUQAPNRCU-UHFFFAOYSA-N
XLogP1.40
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.11
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(difluoromethyl)-5-fluoro-3-nitropyridine-2-carboxamide
CID 118840768
3-(difluoromethyl)-4,5-diiodopyridine-2-carboxamide
CID 130100754
4-(difluoromethyl)-3-fluoro-5-methoxypyridine-2-carboxamide
CID 118852090
4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide
CID 118816543
3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide
CID 118840960
5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide
CID 130105795
3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide
CID 130103158
5-bromo-4-(difluoromethyl)-3-iodopyridine-2-carboxamide
CID 130068606
3-(difluoromethyl)-4-fluoro-6-methylpyridine-2-carboxamide
CID 130081330
4-(difluoromethyl)-3-iodo-5-methoxypyridine-2-carboxamide
CID 118835097
3-(difluoromethyl)-5-fluoro-4-methoxypyridine-2-carboxylic acid
CID 130080806
3-(difluoromethyl)-2,5-diiodopyridine-4-carboxamide
CID 130100748

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide?
The IUPAC name of 3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide (CID 118807178) is 3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide.
What is the SMILES notation for 3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide?
The canonical SMILES for 3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide is NC(=O)c1ncc(F)c(F)c1C(F)F.
What is the InChIKey of 3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide?
The InChIKey is PUTNXCUQAPNRCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F4N2O/c8-2-1-13-5(7(12)14)3(4(2)9)6(10)11/h1,6H,(H2,12,14).
What are the key properties of 3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide?
3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide has a molecular weight of 208.11 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide is sourced from PubChem (CID 118807178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).