4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine

C7H4ClF5N2 — CID 130102768

IUPAC4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine
SMILESNc1cnc(C(F)(F)F)c(C(F)F)c1Cl
InChIInChI=1S/C7H4ClF5N2/c8-4-2(14)1-15-5(7(11,12)13)3(4)6(9)10/h1,6H,14H2
InChIKeyRMEAYYIBYHOXCD-UHFFFAOYSA-N
MW246.57 g/mol
LogP3.27
Rot. Bonds1

About 4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine

4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine (PubChem CID 130102768) has the molecular formula C7H4ClF5N2 and a molecular weight of 246.57 g/mol. Its IUPAC name is 4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine.

Molecular Properties

Compound Name4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine
PubChem CID130102768
Molecular FormulaC7H4ClF5N2
Molecular Weight246.57 g/mol
Exact Mass246.00
IUPAC Name4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine
SMILESNc1cnc(C(F)(F)F)c(C(F)F)c1Cl
InChIInChI=1S/C7H4ClF5N2/c8-4-2(14)1-15-5(7(11,12)13)3(4)6(9)10/h1,6H,14H2
InChIKeyRMEAYYIBYHOXCD-UHFFFAOYSA-N
XLogP3.27
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.57
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(difluoromethyl)-4-fluoro-6-(trifluoromethyl)pyridin-3-amine
CID 130104128
3-(difluoromethyl)-5-methyl-2-(trifluoromethyl)pyridin-4-amine
CID 118806773
[5-chloro-3-(difluoromethyl)-2-(trifluoromethyl)-4-pyridinyl]methanamine
CID 118846102
[5-amino-4-chloro-3-(difluoromethyl)-2-pyridinyl]methanol
CID 130102835
6-(bromomethyl)-4-chloro-5-(difluoromethyl)pyridin-3-amine
CID 130102704
5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 130103084
2-[5-chloro-4-(difluoromethyl)-6-(trifluoromethyl)-3-pyridinyl]acetic acid
CID 134684141
4,5-dichloro-3-(difluoromethyl)pyridin-2-amine
CID 119024495
[4-chloro-5-(difluoromethyl)-2-(trifluoromethyl)-3-pyridinyl]methanamine
CID 130074919
5-(difluoromethyl)-6-iodo-4-(trifluoromethyl)pyridin-3-amine
CID 130105403
5-amino-4-chloro-2-(difluoromethyl)pyridin-3-ol
CID 130102480
3-(difluoromethyl)-5-(trifluoromethyl)pyridine-2,4-diamine
CID 119006850

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine?
The IUPAC name of 4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine (CID 130102768) is 4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine.
What is the SMILES notation for 4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine?
The canonical SMILES for 4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine is Nc1cnc(C(F)(F)F)c(C(F)F)c1Cl.
What is the InChIKey of 4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine?
The InChIKey is RMEAYYIBYHOXCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4ClF5N2/c8-4-2(14)1-15-5(7(11,12)13)3(4)6(9)10/h1,6H,14H2.
What are the key properties of 4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine?
4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine has a molecular weight of 246.57 g/mol, XLogP of 3.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine is sourced from PubChem (CID 130102768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).