4,5-dichloro-3-(difluoromethyl)pyridin-2-amine

C6H4Cl2F2N2 — CID 119024495

IUPAC4,5-dichloro-3-(difluoromethyl)pyridin-2-amine
SMILESNc1ncc(Cl)c(Cl)c1C(F)F
InChIInChI=1S/C6H4Cl2F2N2/c7-2-1-12-6(11)3(4(2)8)5(9)10/h1,5H,(H2,11,12)
InChIKeyZKCDURIJSNPVQB-UHFFFAOYSA-N
MW213.01 g/mol
LogP2.91
Rot. Bonds1

About 4,5-dichloro-3-(difluoromethyl)pyridin-2-amine

4,5-dichloro-3-(difluoromethyl)pyridin-2-amine (PubChem CID 119024495) has the molecular formula C6H4Cl2F2N2 and a molecular weight of 213.01 g/mol. Its IUPAC name is 4,5-dichloro-3-(difluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name4,5-dichloro-3-(difluoromethyl)pyridin-2-amine
PubChem CID119024495
Molecular FormulaC6H4Cl2F2N2
Molecular Weight213.01 g/mol
Exact Mass211.97
IUPAC Name4,5-dichloro-3-(difluoromethyl)pyridin-2-amine
SMILESNc1ncc(Cl)c(Cl)c1C(F)F
InChIInChI=1S/C6H4Cl2F2N2/c7-2-1-12-6(11)3(4(2)8)5(9)10/h1,5H,(H2,11,12)
InChIKeyZKCDURIJSNPVQB-UHFFFAOYSA-N
XLogP2.91
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.01
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-amino-4-chloro-5-(difluoromethyl)pyridine-3-sulfonamide
CID 119016728
2-amino-5-chloro-3-(difluoromethyl)pyridine-4-carboxamide
CID 119014359
2-amino-5-chloro-4-(difluoromethyl)pyridine-3-sulfonamide
CID 119021143
4,5-dichloro-3-(difluoromethyl)pyridine-2-carboxylic acid
CID 130099404
4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine
CID 130102768
3-(difluoromethyl)-4,5-diiodopyridin-2-amine
CID 118996256
2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine
CID 119019803
3-(difluoromethyl)-5-fluoro-4-methylpyridin-2-amine
CID 119000809
5-bromo-3-(difluoromethyl)-4-fluoropyridin-2-amine
CID 119016781
2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol
CID 130101681
3-(difluoromethyl)-5-(trifluoromethyl)pyridine-2,4-diamine
CID 119006850
3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide
CID 130103158

Frequently Asked Questions

What is the IUPAC name of 4,5-dichloro-3-(difluoromethyl)pyridin-2-amine?
The IUPAC name of 4,5-dichloro-3-(difluoromethyl)pyridin-2-amine (CID 119024495) is 4,5-dichloro-3-(difluoromethyl)pyridin-2-amine.
What is the SMILES notation for 4,5-dichloro-3-(difluoromethyl)pyridin-2-amine?
The canonical SMILES for 4,5-dichloro-3-(difluoromethyl)pyridin-2-amine is Nc1ncc(Cl)c(Cl)c1C(F)F.
What is the InChIKey of 4,5-dichloro-3-(difluoromethyl)pyridin-2-amine?
The InChIKey is ZKCDURIJSNPVQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Cl2F2N2/c7-2-1-12-6(11)3(4(2)8)5(9)10/h1,5H,(H2,11,12).
What are the key properties of 4,5-dichloro-3-(difluoromethyl)pyridin-2-amine?
4,5-dichloro-3-(difluoromethyl)pyridin-2-amine has a molecular weight of 213.01 g/mol, XLogP of 2.91, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dichloro-3-(difluoromethyl)pyridin-2-amine is sourced from PubChem (CID 119024495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).