3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine

C7H7ClF3N3O — CID 119016292

IUPAC3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine
SMILESNCc1c(Cl)cc(OC(F)(F)F)nc1N
InChIInChI=1S/C7H7ClF3N3O/c8-4-1-5(15-7(9,10)11)14-6(13)3(4)2-12/h1H,2,12H2,(H2,13,14)
InChIKeyJTLASFCLSNZLIT-UHFFFAOYSA-N
MW241.60 g/mol
LogP1.67
Rot. Bonds2

About 3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine

3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine (PubChem CID 119016292) has the molecular formula C7H7ClF3N3O and a molecular weight of 241.60 g/mol. Its IUPAC name is 3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine
PubChem CID119016292
Molecular FormulaC7H7ClF3N3O
Molecular Weight241.60 g/mol
Exact Mass241.02
IUPAC Name3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine
SMILESNCc1c(Cl)cc(OC(F)(F)F)nc1N
InChIInChI=1S/C7H7ClF3N3O/c8-4-1-5(15-7(9,10)11)14-6(13)3(4)2-12/h1H,2,12H2,(H2,13,14)
InChIKeyJTLASFCLSNZLIT-UHFFFAOYSA-N
XLogP1.67
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.60
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(aminomethyl)-6-methoxy-4-(trifluoromethoxy)pyridin-2-amine
CID 133086223
3-(aminomethyl)-2-iodo-6-(trifluoromethoxy)pyridin-4-amine
CID 131601200
4-(aminomethyl)-3-iodo-6-(trifluoromethoxy)pyridin-2-amine
CID 119006806
3-(aminomethyl)-6-(trifluoromethoxy)-2-(trifluoromethyl)pyridin-4-amine
CID 118823698
[2,4-dimethyl-6-(trifluoromethoxy)-3-pyridinyl]methanamine
CID 131266022
2-amino-4-(aminomethyl)-6-(trifluoromethoxy)pyridine-3-carboxylic acid
CID 119009677
4-(aminomethyl)-3-chloro-5-(trifluoromethoxy)pyridin-2-amine
CID 119001282
[2-iodo-6-(trifluoromethoxy)-4-pyridinyl]methanamine
CID 130092413
[3-bromo-2-chloro-6-(trifluoromethoxy)-4-pyridinyl]methanamine
CID 118807331
[3-(aminomethyl)-6-(trifluoromethoxy)-2-(trifluoromethyl)-4-pyridinyl]methanol
CID 134670747
6-(aminomethyl)-3-chloro-2-(trifluoromethoxy)pyridin-4-amine
CID 133085760
4-chloro-2-(hydroxymethyl)-6-(trifluoromethoxy)pyridin-3-ol
CID 118811553

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine?
The IUPAC name of 3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine (CID 119016292) is 3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine?
The canonical SMILES for 3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine is NCc1c(Cl)cc(OC(F)(F)F)nc1N.
What is the InChIKey of 3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine?
The InChIKey is JTLASFCLSNZLIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClF3N3O/c8-4-1-5(15-7(9,10)11)14-6(13)3(4)2-12/h1H,2,12H2,(H2,13,14).
What are the key properties of 3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine?
3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine has a molecular weight of 241.60 g/mol, XLogP of 1.67, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-4-chloro-6-(trifluoromethoxy)pyridin-2-amine is sourced from PubChem (CID 119016292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).