3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride

C6H12ClF2N — CID 122163160

IUPAC3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride
SMILESCl.NCC(F)(F)CC1CC1
InChIInChI=1S/C6H11F2N.ClH/c7-6(8,4-9)3-5-1-2-5;/h5H,1-4,9H2;1H
InChIKeySPZDWWCMXLDXAW-UHFFFAOYSA-N
MW171.62 g/mol
LogP1.80
Rot. Bonds3

About 3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride

3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride (PubChem CID 122163160) has the molecular formula C6H12ClF2N and a molecular weight of 171.62 g/mol. Its IUPAC name is 3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride.

Molecular Properties

Compound Name3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride
PubChem CID122163160
Molecular FormulaC6H12ClF2N
Molecular Weight171.62 g/mol
Exact Mass171.06
IUPAC Name3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride
SMILESCl.NCC(F)(F)CC1CC1
InChIInChI=1S/C6H11F2N.ClH/c7-6(8,4-9)3-5-1-2-5;/h5H,1-4,9H2;1H
InChIKeySPZDWWCMXLDXAW-UHFFFAOYSA-N
XLogP1.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.62
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-cyclopropyl-2,2-difluoropropan-1-amine;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 3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride?
The IUPAC name of 3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride (CID 122163160) is 3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride.
What is the SMILES notation for 3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride?
The canonical SMILES for 3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride is Cl.NCC(F)(F)CC1CC1.
What is the InChIKey of 3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride?
The InChIKey is SPZDWWCMXLDXAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2N.ClH/c7-6(8,4-9)3-5-1-2-5;/h5H,1-4,9H2;1H.
What are the key properties of 3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride?
3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride has a molecular weight of 171.62 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-2,2-difluoropropan-1-amine;hydrochloride is sourced from PubChem (CID 122163160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).