4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine

C12H7F5N2 — CID 119001740

IUPAC4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESNc1cc(-c2cccc(F)c2F)c(C(F)(F)F)cn1
InChIInChI=1S/C12H7F5N2/c13-9-3-1-2-6(11(9)14)7-4-10(18)19-5-8(7)12(15,16)17/h1-5H,(H2,18,19)
InChIKeyZRMFOXRGNLFTFF-UHFFFAOYSA-N
MW274.19 g/mol
LogP3.63
Rot. Bonds1

About 4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine

4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine (PubChem CID 119001740) has the molecular formula C12H7F5N2 and a molecular weight of 274.19 g/mol. Its IUPAC name is 4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine
PubChem CID119001740
Molecular FormulaC12H7F5N2
Molecular Weight274.19 g/mol
Exact Mass274.05
IUPAC Name4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESNc1cc(-c2cccc(F)c2F)c(C(F)(F)F)cn1
InChIInChI=1S/C12H7F5N2/c13-9-3-1-2-6(11(9)14)7-4-10(18)19-5-8(7)12(15,16)17/h1-5H,(H2,18,19)
InChIKeyZRMFOXRGNLFTFF-UHFFFAOYSA-N
XLogP3.63
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.19
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-methylphenyl)-5-(trifluoromethyl)pyridin-2-amine
CID 153325933
2-(2,3-difluorophenyl)-4-iodo-5-(trifluoromethyl)pyridine
CID 118819254
1-[5-chloro-2-(trifluoromethyl)phenyl]-2,3-difluorobenzene
CID 134629587
5-(trifluoromethyl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-amine
CID 119003597
1,2-difluoro-3-[2-methyl-6-(trifluoromethyl)phenyl]benzene
CID 118843388
1-[4-chloro-2-(trifluoromethyl)phenyl]-2,3-difluorobenzene
CID 118822699
8-(trifluoromethyl)isoquinolin-3-amine
CID 71742569
2-[2-(2,3-difluorophenyl)-5-(trifluoromethyl)-4-pyridinyl]acetic acid
CID 118836266
6-amino-5-(2,3-difluorophenyl)pyridine-3-carboxylic acid
CID 133086684
3,5-bis(2,3-difluorophenyl)pyridin-2-amine
CID 133086642
2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine
CID 170837725
1-(2,3-difluorophenyl)-3-fluoro-2-methyl-4-(trifluoromethyl)benzene
CID 157221283

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine (CID 119001740) is 4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine is Nc1cc(-c2cccc(F)c2F)c(C(F)(F)F)cn1.
What is the InChIKey of 4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine?
The InChIKey is ZRMFOXRGNLFTFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7F5N2/c13-9-3-1-2-6(11(9)14)7-4-10(18)19-5-8(7)12(15,16)17/h1-5H,(H2,18,19).
What are the key properties of 4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine?
4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine has a molecular weight of 274.19 g/mol, XLogP of 3.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 119001740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).