4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane

C8H10ClF3N2 — CID 167491380

IUPAC4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane
SMILESCC.Nc1nccc(Cl)c1C(F)(F)F
InChIInChI=1S/C6H4ClF3N2.C2H6/c7-3-1-2-12-5(11)4(3)6(8,9)10;1-2/h1-2H,(H2,11,12);1-2H3
InChIKeyJKFMMKYSZXODOY-UHFFFAOYSA-N
MW226.63 g/mol
LogP3.36
Rot. Bonds

About 4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane

4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane (PubChem CID 167491380) has the molecular formula C8H10ClF3N2 and a molecular weight of 226.63 g/mol. Its IUPAC name is 4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane.

Molecular Properties

Compound Name4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane
PubChem CID167491380
Molecular FormulaC8H10ClF3N2
Molecular Weight226.63 g/mol
Exact Mass226.05
IUPAC Name4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane
SMILESCC.Nc1nccc(Cl)c1C(F)(F)F
InChIInChI=1S/C6H4ClF3N2.C2H6/c7-3-1-2-12-5(11)4(3)6(8,9)10;1-2/h1-2H,(H2,11,12);1-2H3
InChIKeyJKFMMKYSZXODOY-UHFFFAOYSA-N
XLogP3.36
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.63
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine
CID 118248035
4-(3-methylbutan-2-ylsulfanyl)-3-(trifluoromethyl)pyridin-2-amine
CID 135228327
3-(2,3,4,5,6-pentachlorophenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 134618434
2-amino-4-chloro-3-(trifluoromethyl)phenol
CID 58148280
methyl 2-[4-chloro-3-(trifluoromethyl)-2-pyridinyl]acetate
CID 133097693
3-tert-butyl-2,4-dichloropyridine
CID 152672393
[2-amino-4-(trifluoromethyl)-3-pyridinyl]methanol
CID 118704003
2-(2,6-dichlorophenyl)-3-methoxy-4-(trifluoromethyl)pyridine
CID 118830574
4-chloro-3-(4-fluorophenyl)pyridin-2-amine
CID 119054060
2-methoxy-3-(trifluoromethyl)pyridin-4-amine
CID 118806319
4-tert-butyl-3-fluoropyridin-2-amine
CID 126653136
4-chloro-2-iodo-3-(trifluoromethyl)aniline
CID 118805865

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane?
The IUPAC name of 4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane (CID 167491380) is 4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane.
What is the SMILES notation for 4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane?
The canonical SMILES for 4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane is CC.Nc1nccc(Cl)c1C(F)(F)F.
What is the InChIKey of 4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane?
The InChIKey is JKFMMKYSZXODOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4ClF3N2.C2H6/c7-3-1-2-12-5(11)4(3)6(8,9)10;1-2/h1-2H,(H2,11,12);1-2H3.
What are the key properties of 4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane?
4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane has a molecular weight of 226.63 g/mol, XLogP of 3.36, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane is sourced from PubChem (CID 167491380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).