2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine

C7H9F3N2 — CID 162568730

IUPAC2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine
SMILESCC1(N)C=CC(C(F)(F)F)=CN1
InChIInChI=1S/C7H9F3N2/c1-6(11)3-2-5(4-12-6)7(8,9)10/h2-4,12H,11H2,1H3
InChIKeyKWMNTQMVONLXNW-UHFFFAOYSA-N
MW178.16 g/mol
LogP1.27
Rot. Bonds

About 2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine

2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine (PubChem CID 162568730) has the molecular formula C7H9F3N2 and a molecular weight of 178.16 g/mol. Its IUPAC name is 2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine.

Molecular Properties

Compound Name2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine
PubChem CID162568730
Molecular FormulaC7H9F3N2
Molecular Weight178.16 g/mol
Exact Mass178.07
IUPAC Name2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine
SMILESCC1(N)C=CC(C(F)(F)F)=CN1
InChIInChI=1S/C7H9F3N2/c1-6(11)3-2-5(4-12-6)7(8,9)10/h2-4,12H,11H2,1H3
InChIKeyKWMNTQMVONLXNW-UHFFFAOYSA-N
XLogP1.27
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.16
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine?
The IUPAC name of 2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine (CID 162568730) is 2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine.
What is the SMILES notation for 2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine?
The canonical SMILES for 2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine is CC1(N)C=CC(C(F)(F)F)=CN1.
What is the InChIKey of 2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine?
The InChIKey is KWMNTQMVONLXNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F3N2/c1-6(11)3-2-5(4-12-6)7(8,9)10/h2-4,12H,11H2,1H3.
What are the key properties of 2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine?
2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine has a molecular weight of 178.16 g/mol, XLogP of 1.27, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(trifluoromethyl)-1H-pyridin-2-amine is sourced from PubChem (CID 162568730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).