4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide

C7H6F3N3O — CID 118816543

IUPAC4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide
SMILESNC(=O)c1ncc(C(F)F)c(N)c1F
InChIInChI=1S/C7H6F3N3O/c8-3-4(11)2(6(9)10)1-13-5(3)7(12)14/h1,6H,(H2,11,13)(H2,12,14)
InChIKeyVGYDOSVCPDCEHS-UHFFFAOYSA-N
MW205.14 g/mol
LogP0.84
Rot. Bonds2

About 4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide

4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide (PubChem CID 118816543) has the molecular formula C7H6F3N3O and a molecular weight of 205.14 g/mol. Its IUPAC name is 4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide.

Molecular Properties

Compound Name4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide
PubChem CID118816543
Molecular FormulaC7H6F3N3O
Molecular Weight205.14 g/mol
Exact Mass205.05
IUPAC Name4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide
SMILESNC(=O)c1ncc(C(F)F)c(N)c1F
InChIInChI=1S/C7H6F3N3O/c8-3-4(11)2(6(9)10)1-13-5(3)7(12)14/h1,6H,(H2,11,13)(H2,12,14)
InChIKeyVGYDOSVCPDCEHS-UHFFFAOYSA-N
XLogP0.84
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.14
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide?
The IUPAC name of 4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide (CID 118816543) is 4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide.
What is the SMILES notation for 4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide?
The canonical SMILES for 4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide is NC(=O)c1ncc(C(F)F)c(N)c1F.
What is the InChIKey of 4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide?
The InChIKey is VGYDOSVCPDCEHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F3N3O/c8-3-4(11)2(6(9)10)1-13-5(3)7(12)14/h1,6H,(H2,11,13)(H2,12,14).
What are the key properties of 4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide?
4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide has a molecular weight of 205.14 g/mol, XLogP of 0.84, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide is sourced from PubChem (CID 118816543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).