3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide

C7H6ClF2N3O — CID 130103158

IUPAC3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide
SMILESNC(=O)c1ncc(Cl)c(C(F)F)c1N
InChIInChI=1S/C7H6ClF2N3O/c8-2-1-13-5(7(12)14)4(11)3(2)6(9)10/h1,6H,11H2,(H2,12,14)
InChIKeyOKCJVEABMJZXLS-UHFFFAOYSA-N
MW221.59 g/mol
LogP1.35
Rot. Bonds2

About 3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide

3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide (PubChem CID 130103158) has the molecular formula C7H6ClF2N3O and a molecular weight of 221.59 g/mol. Its IUPAC name is 3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide
PubChem CID130103158
Molecular FormulaC7H6ClF2N3O
Molecular Weight221.59 g/mol
Exact Mass221.02
IUPAC Name3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide
SMILESNC(=O)c1ncc(Cl)c(C(F)F)c1N
InChIInChI=1S/C7H6ClF2N3O/c8-2-1-13-5(7(12)14)4(11)3(2)6(9)10/h1,6H,11H2,(H2,12,14)
InChIKeyOKCJVEABMJZXLS-UHFFFAOYSA-N
XLogP1.35
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.59
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-5-chloro-3-(difluoromethyl)pyridine-4-carboxamide
CID 119014359
5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide
CID 130105795
5-chloro-3-(difluoromethyl)-2-fluoropyridine-4-carboxamide
CID 130072218
4-amino-6-chloro-5-(difluoromethyl)pyridine-3-carboxamide
CID 118839727
3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide
CID 118807178
4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide
CID 118816543
4,5-dichloro-3-(difluoromethyl)pyridine-2-carboxylic acid
CID 130099404
3-(difluoromethyl)-4,5-diiodopyridine-2-carboxamide
CID 130100754
5-bromo-4-(difluoromethyl)-3-iodopyridine-2-carboxamide
CID 130068606
ethyl 5-chloro-4-(difluoromethyl)-3-(trifluoromethyl)pyridine-2-carboxylate
CID 134675024
4-(difluoromethyl)-3-fluoro-5-methoxypyridine-2-carboxamide
CID 118852090
4,5-dichloro-3-(difluoromethyl)pyridin-2-amine
CID 119024495

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide (CID 130103158) is 3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide is NC(=O)c1ncc(Cl)c(C(F)F)c1N.
What is the InChIKey of 3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide?
The InChIKey is OKCJVEABMJZXLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClF2N3O/c8-2-1-13-5(7(12)14)4(11)3(2)6(9)10/h1,6H,11H2,(H2,12,14).
What are the key properties of 3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide?
3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide has a molecular weight of 221.59 g/mol, XLogP of 1.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 130103158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).