6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile

C7H4F3N3 — CID 119020377

IUPAC6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile
SMILESN#Cc1cnc(N)c(C(F)F)c1F
InChIInChI=1S/C7H4F3N3/c8-5-3(1-11)2-13-7(12)4(5)6(9)10/h2,6H,(H2,12,13)
InChIKeyYVZZZCIGDGRFRM-UHFFFAOYSA-N
MW187.12 g/mol
LogP1.61
Rot. Bonds1

About 6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile

6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile (PubChem CID 119020377) has the molecular formula C7H4F3N3 and a molecular weight of 187.12 g/mol. Its IUPAC name is 6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile.

Molecular Properties

Compound Name6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile
PubChem CID119020377
Molecular FormulaC7H4F3N3
Molecular Weight187.12 g/mol
Exact Mass187.04
IUPAC Name6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile
SMILESN#Cc1cnc(N)c(C(F)F)c1F
InChIInChI=1S/C7H4F3N3/c8-5-3(1-11)2-13-7(12)4(5)6(9)10/h2,6H,(H2,12,13)
InChIKeyYVZZZCIGDGRFRM-UHFFFAOYSA-N
XLogP1.61
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.12
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-cyano-3-(difluoromethyl)-4-fluoropyridine-2-sulfonyl chloride
CID 130076373
2-[2-amino-5-cyano-3-(difluoromethyl)-4-pyridinyl]acetic acid
CID 119023577
5-bromo-3-(difluoromethyl)-4-fluoropyridin-2-amine
CID 119016781
5-(aminomethyl)-6-(difluoromethyl)-4-fluoropyridine-3-carbonitrile
CID 130076050
5-amino-4-(difluoromethyl)-6-formylpyridine-3-carbonitrile
CID 130103617
6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carboxylic acid
CID 119006652
5-cyano-4-(difluoromethyl)-2-fluoropyridine-3-sulfonamide
CID 134669756
6-amino-4-cyano-5-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 130103695
5-amino-4-(difluoromethyl)-6-(trifluoromethoxy)pyridine-3-carbonitrile
CID 133095321
4-(cyanomethyl)-5-(difluoromethyl)-6-fluoropyridine-3-carbonitrile
CID 134675025
5-(difluoromethyl)-4-methyl-6-(trifluoromethyl)pyridine-3-carbonitrile
CID 134685708
5-(difluoromethyl)-6-fluoro-4-formylpyridine-3-carbonitrile
CID 130076244

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile?
The IUPAC name of 6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile (CID 119020377) is 6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile.
What is the SMILES notation for 6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile?
The canonical SMILES for 6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile is N#Cc1cnc(N)c(C(F)F)c1F.
What is the InChIKey of 6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile?
The InChIKey is YVZZZCIGDGRFRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F3N3/c8-5-3(1-11)2-13-7(12)4(5)6(9)10/h2,6H,(H2,12,13).
What are the key properties of 6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile?
6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile has a molecular weight of 187.12 g/mol, XLogP of 1.61, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-(difluoromethyl)-4-fluoropyridine-3-carbonitrile is sourced from PubChem (CID 119020377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).