(2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride

C10H13ClFN — CID 154810076

IUPAC(2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride
SMILESCl.NCc1ccc(F)cc1C1CC1
InChIInChI=1S/C10H12FN.ClH/c11-9-4-3-8(6-12)10(5-9)7-1-2-7;/h3-5,7H,1-2,6,12H2;1H
InChIKeyDBSRBOOWBOIYSJ-UHFFFAOYSA-N
MW201.67 g/mol
LogP2.58
Rot. Bonds2

About (2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride

(2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride (PubChem CID 154810076) has the molecular formula C10H13ClFN and a molecular weight of 201.67 g/mol. Its IUPAC name is (2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride
PubChem CID154810076
Molecular FormulaC10H13ClFN
Molecular Weight201.67 g/mol
Exact Mass201.07
IUPAC Name(2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride
SMILESCl.NCc1ccc(F)cc1C1CC1
InChIInChI=1S/C10H12FN.ClH/c11-9-4-3-8(6-12)10(5-9)7-1-2-7;/h3-5,7H,1-2,6,12H2;1H
InChIKeyDBSRBOOWBOIYSJ-UHFFFAOYSA-N
XLogP2.58
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.67
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2-cyclopropyl-4-fluorophenyl)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

Frequently Asked Questions

What is the IUPAC name of (2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride?
The IUPAC name of (2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride (CID 154810076) is (2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride.
What is the SMILES notation for (2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride?
The canonical SMILES for (2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride is Cl.NCc1ccc(F)cc1C1CC1.
What is the InChIKey of (2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride?
The InChIKey is DBSRBOOWBOIYSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN.ClH/c11-9-4-3-8(6-12)10(5-9)7-1-2-7;/h3-5,7H,1-2,6,12H2;1H.
What are the key properties of (2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride?
(2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride has a molecular weight of 201.67 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropyl-4-fluorophenyl)methanamine;hydrochloride is sourced from PubChem (CID 154810076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).