(3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride

C4H9ClF2N2 — CID 170923039

IUPAC(3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride
SMILESCl.N[C@@H]1CNCC1(F)F
InChIInChI=1S/C4H8F2N2.ClH/c5-4(6)2-8-1-3(4)7;/h3,8H,1-2,7H2;1H/t3-;/m1./s1
InChIKeyOHVRUSXHQUQQGV-AENDTGMFSA-N
MW158.58 g/mol
LogP-0.03
Rot. Bonds

About (3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride

(3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride (PubChem CID 170923039) has the molecular formula C4H9ClF2N2 and a molecular weight of 158.58 g/mol. Its IUPAC name is (3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride.

Molecular Properties

Compound Name(3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride
PubChem CID170923039
Molecular FormulaC4H9ClF2N2
Molecular Weight158.58 g/mol
Exact Mass158.04
IUPAC Name(3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride
SMILESCl.N[C@@H]1CNCC1(F)F
InChIInChI=1S/C4H8F2N2.ClH/c5-4(6)2-8-1-3(4)7;/h3,8H,1-2,7H2;1H/t3-;/m1./s1
InChIKeyOHVRUSXHQUQQGV-AENDTGMFSA-N
XLogP-0.03
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.58
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (3R)-4,4-difluoropyrrolidin-3-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

Related Compounds

4,4-difluoropiperidin-3-amine;hydrochloride
CID 121487885
4,4-difluoropiperidin-3-amine
CID 86775600
5-azaspiro[2.4]heptan-7-amine;dihydrochloride
CID 22033764
ethane;4-ethyl-3,3-difluoropyrrolidine
CID 177028431
3,3,4,5-tetrafluoropiperidine
CID 91309126
3a-fluoro-2,3,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-amine
CID 138719512
4,4-diethylpyrrolidin-3-amine
CID 149278511
3a-fluoro-2,3,4,5,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;ethane;hydrofluoride
CID 177136763
3,3-difluoro-4-pyrrolidin-1-ylpyrrolidine
CID 115014675
3,3-difluoro-4-(methylsulfonylmethyl)pyrrolidine
CID 105452015
3,3-difluoro-4-prop-1-en-2-ylpyrrolidine
CID 162620781
4,4-dipropylpyrrolidin-3-amine
CID 165454164

Frequently Asked Questions

What is the IUPAC name of (3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride?
The IUPAC name of (3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride (CID 170923039) is (3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride.
What is the SMILES notation for (3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride?
The canonical SMILES for (3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride is Cl.N[C@@H]1CNCC1(F)F.
What is the InChIKey of (3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride?
The InChIKey is OHVRUSXHQUQQGV-AENDTGMFSA-N. The full InChI is InChI=1S/C4H8F2N2.ClH/c5-4(6)2-8-1-3(4)7;/h3,8H,1-2,7H2;1H/t3-;/m1./s1.
What are the key properties of (3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride?
(3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride has a molecular weight of 158.58 g/mol, XLogP of -0.03, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride is sourced from PubChem (CID 170923039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).