2-cyclopropyl-2,2-difluoroethanamine;hydrochloride

C5H10ClF2N — CID 119030504

IUPAC2-cyclopropyl-2,2-difluoroethanamine;hydrochloride
SMILESCl.NCC(F)(F)C1CC1
InChIInChI=1S/C5H9F2N.ClH/c6-5(7,3-8)4-1-2-4;/h4H,1-3,8H2;1H
InChIKeyIRIRLENGLQGZNC-UHFFFAOYSA-N
MW157.59 g/mol
LogP1.41
Rot. Bonds2

About 2-cyclopropyl-2,2-difluoroethanamine;hydrochloride

2-cyclopropyl-2,2-difluoroethanamine;hydrochloride (PubChem CID 119030504) has the molecular formula C5H10ClF2N and a molecular weight of 157.59 g/mol. Its IUPAC name is 2-cyclopropyl-2,2-difluoroethanamine;hydrochloride.

Molecular Properties

Compound Name2-cyclopropyl-2,2-difluoroethanamine;hydrochloride
PubChem CID119030504
Molecular FormulaC5H10ClF2N
Molecular Weight157.59 g/mol
Exact Mass157.05
IUPAC Name2-cyclopropyl-2,2-difluoroethanamine;hydrochloride
SMILESCl.NCC(F)(F)C1CC1
InChIInChI=1S/C5H9F2N.ClH/c6-5(7,3-8)4-1-2-4;/h4H,1-3,8H2;1H
InChIKeyIRIRLENGLQGZNC-UHFFFAOYSA-N
XLogP1.41
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.59
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-cyclopropyl-2,2-difluoroethanamine;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-2,2-difluoroethanamine;hydrochloride?
The IUPAC name of 2-cyclopropyl-2,2-difluoroethanamine;hydrochloride (CID 119030504) is 2-cyclopropyl-2,2-difluoroethanamine;hydrochloride.
What is the SMILES notation for 2-cyclopropyl-2,2-difluoroethanamine;hydrochloride?
The canonical SMILES for 2-cyclopropyl-2,2-difluoroethanamine;hydrochloride is Cl.NCC(F)(F)C1CC1.
What is the InChIKey of 2-cyclopropyl-2,2-difluoroethanamine;hydrochloride?
The InChIKey is IRIRLENGLQGZNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F2N.ClH/c6-5(7,3-8)4-1-2-4;/h4H,1-3,8H2;1H.
What are the key properties of 2-cyclopropyl-2,2-difluoroethanamine;hydrochloride?
2-cyclopropyl-2,2-difluoroethanamine;hydrochloride has a molecular weight of 157.59 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2,2-difluoroethanamine;hydrochloride is sourced from PubChem (CID 119030504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).