5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide

C7H8F2N4O — CID 119003054

IUPAC5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide
SMILESNC(=O)c1cc(N)c(N)nc1C(F)F
InChIInChI=1S/C7H8F2N4O/c8-5(9)4-2(7(12)14)1-3(10)6(11)13-4/h1,5H,10H2,(H2,11,13)(H2,12,14)
InChIKeyXFBKERLRLQICNG-UHFFFAOYSA-N
MW202.16 g/mol
LogP0.28
Rot. Bonds2

About 5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide

5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide (PubChem CID 119003054) has the molecular formula C7H8F2N4O and a molecular weight of 202.16 g/mol. Its IUPAC name is 5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide
PubChem CID119003054
Molecular FormulaC7H8F2N4O
Molecular Weight202.16 g/mol
Exact Mass202.07
IUPAC Name5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide
SMILESNC(=O)c1cc(N)c(N)nc1C(F)F
InChIInChI=1S/C7H8F2N4O/c8-5(9)4-2(7(12)14)1-3(10)6(11)13-4/h1,5H,10H2,(H2,11,13)(H2,12,14)
InChIKeyXFBKERLRLQICNG-UHFFFAOYSA-N
XLogP0.28
TPSA108.02 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.16
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(difluoromethyl)-5-hydroxy-6-iodopyridine-3-carboxamide
CID 118809374
2,3-diamino-6-(difluoromethyl)pyridine-4-carboxamide
CID 119018170
6-(difluoromethyl)-5-fluoropyridine-2,3-diamine
CID 130098596
2-amino-3-(difluoromethyl)-6-fluoropyridine-4-carboxamide
CID 118998716
6-amino-2-(difluoromethyl)-3-hydroxypyridine-4-carboxamide
CID 130105130
5-amino-6-(difluoromethyl)-3-methylpyridine-2-carboxamide
CID 130106784
6-amino-5-chloro-2-(difluoromethyl)pyridine-3-carbonyl chloride
CID 130103005
5-(aminomethyl)-6-(difluoromethyl)pyridine-2,3-diamine
CID 130098671
6-(aminomethyl)-2-(difluoromethyl)-5-(trifluoromethoxy)pyridine-3-carboxamide
CID 118808662
6-(difluoromethyl)-5-hydroxy-2-methylpyridine-3-carboxamide
CID 118837404
2-(difluoromethyl)-5-iodopyridine-3-carboxamide
CID 118837602
6-(difluoromethyl)-5-nitropyridine-2,3-diamine
CID 119002066

Frequently Asked Questions

What is the IUPAC name of 5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide (CID 119003054) is 5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide is NC(=O)c1cc(N)c(N)nc1C(F)F.
What is the InChIKey of 5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide?
The InChIKey is XFBKERLRLQICNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N4O/c8-5(9)4-2(7(12)14)1-3(10)6(11)13-4/h1,5H,10H2,(H2,11,13)(H2,12,14).
What are the key properties of 5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide?
5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide has a molecular weight of 202.16 g/mol, XLogP of 0.28, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 119003054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).