6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine

C16H15F3N2 — CID 162607435

IUPAC6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine
SMILESCNc1ccc(C(F)(F)F)c(-c2ccccc2C2CC2)n1
InChIInChI=1S/C16H15F3N2/c1-20-14-9-8-13(16(17,18)19)15(21-14)12-5-3-2-4-11(12)10-6-7-10/h2-5,8-10H,6-7H2,1H3,(H,20,21)
InChIKeyBWJFUPHBIOUITJ-UHFFFAOYSA-N
MW292.30 g/mol
LogP4.69
Rot. Bonds3

About 6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine

6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine (PubChem CID 162607435) has the molecular formula C16H15F3N2 and a molecular weight of 292.30 g/mol. Its IUPAC name is 6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine
PubChem CID162607435
Molecular FormulaC16H15F3N2
Molecular Weight292.30 g/mol
Exact Mass292.12
IUPAC Name6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine
SMILESCNc1ccc(C(F)(F)F)c(-c2ccccc2C2CC2)n1
InChIInChI=1S/C16H15F3N2/c1-20-14-9-8-13(16(17,18)19)15(21-14)12-5-3-2-4-11(12)10-6-7-10/h2-5,8-10H,6-7H2,1H3,(H,20,21)
InChIKeyBWJFUPHBIOUITJ-UHFFFAOYSA-N
XLogP4.69
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.30
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine (CID 162607435) is 6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine is CNc1ccc(C(F)(F)F)c(-c2ccccc2C2CC2)n1.
What is the InChIKey of 6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine?
The InChIKey is BWJFUPHBIOUITJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N2/c1-20-14-9-8-13(16(17,18)19)15(21-14)12-5-3-2-4-11(12)10-6-7-10/h2-5,8-10H,6-7H2,1H3,(H,20,21).
What are the key properties of 6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine?
6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine has a molecular weight of 292.30 g/mol, XLogP of 4.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyclopropylphenyl)-N-methyl-5-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 162607435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).