cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride

C10H12ClF3N2 — CID 131637723

IUPACcyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride
SMILESCl.NC(c1ncccc1C(F)(F)F)C1CC1
InChIInChI=1S/C10H11F3N2.ClH/c11-10(12,13)7-2-1-5-15-9(7)8(14)6-3-4-6;/h1-2,5-6,8H,3-4,14H2;1H
InChIKeyZVJHLXQVYWLQLB-UHFFFAOYSA-N
MW252.67 g/mol
LogP2.93
Rot. Bonds2

About cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride

cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride (PubChem CID 131637723) has the molecular formula C10H12ClF3N2 and a molecular weight of 252.67 g/mol. Its IUPAC name is cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride.

Molecular Properties

Compound Namecyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride
PubChem CID131637723
Molecular FormulaC10H12ClF3N2
Molecular Weight252.67 g/mol
Exact Mass252.06
IUPAC Namecyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride
SMILESCl.NC(c1ncccc1C(F)(F)F)C1CC1
InChIInChI=1S/C10H11F3N2.ClH/c11-10(12,13)7-2-1-5-15-9(7)8(14)6-3-4-6;/h1-2,5-6,8H,3-4,14H2;1H
InChIKeyZVJHLXQVYWLQLB-UHFFFAOYSA-N
XLogP2.93
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.67
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S)-1-[3-(trifluoromethyl)-2-pyridinyl]ethanamine
CID 131017310
2-cyclopropyl-2-[3-(trifluoromethyl)-2-pyridinyl]acetic acid
CID 175669164
2-propan-2-yl-3-(trifluoromethyl)pyridine
CID 59735101
(2S)-2-amino-2-[3-(trifluoromethyl)-2-pyridinyl]ethanol
CID 131168070
cyclopropyl-[3-(trifluoromethyl)-4-pyridinyl]methanamine;dihydrochloride
CID 131637722
(S)-cyclopentyl-[2-(trifluoromethyl)phenyl]methanamine;hydrochloride
CID 171226251
(R)-cyclohexyl-[2-(trifluoromethyl)phenyl]methanamine;hydrochloride
CID 171206677
1-cyclopropyl-N-methyl-N-[3-(trifluoromethyl)-2-pyridinyl]ethane-1,2-diamine
CID 116653234
(3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride
CID 178200821
(1S)-3-phenyl-1-[3-(trifluoromethyl)-2-pyridinyl]prop-2-yn-1-amine
CID 71165415
cyclobutyl-[2-(trifluoromethyl)phenyl]methanamine
CID 64986967
(S)-cyclobutyl-[3-(4-fluorophenyl)-2-pyridinyl]methanamine
CID 167230191

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride?
The IUPAC name of cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride (CID 131637723) is cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride.
What is the SMILES notation for cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride?
The canonical SMILES for cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride is Cl.NC(c1ncccc1C(F)(F)F)C1CC1.
What is the InChIKey of cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride?
The InChIKey is ZVJHLXQVYWLQLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2.ClH/c11-10(12,13)7-2-1-5-15-9(7)8(14)6-3-4-6;/h1-2,5-6,8H,3-4,14H2;1H.
What are the key properties of cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride?
cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride has a molecular weight of 252.67 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[3-(trifluoromethyl)-2-pyridinyl]methanamine;hydrochloride is sourced from PubChem (CID 131637723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).