2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride

C6H11ClF2N2O — CID 175377016

IUPAC2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride
SMILESCl.NC(=O)CC1CNCC1(F)F
InChIInChI=1S/C6H10F2N2O.ClH/c7-6(8)3-10-2-4(6)1-5(9)11;/h4,10H,1-3H2,(H2,9,11);1H
InChIKeyIXTXHGWIUYBIKQ-UHFFFAOYSA-N
MW200.62 g/mol
LogP0.14
Rot. Bonds2

About 2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride

2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride (PubChem CID 175377016) has the molecular formula C6H11ClF2N2O and a molecular weight of 200.62 g/mol. Its IUPAC name is 2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride
PubChem CID175377016
Molecular FormulaC6H11ClF2N2O
Molecular Weight200.62 g/mol
Exact Mass200.05
IUPAC Name2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride
SMILESCl.NC(=O)CC1CNCC1(F)F
InChIInChI=1S/C6H10F2N2O.ClH/c7-6(8)3-10-2-4(6)1-5(9)11;/h4,10H,1-3H2,(H2,9,11);1H
InChIKeyIXTXHGWIUYBIKQ-UHFFFAOYSA-N
XLogP0.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.62
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(4,4-difluoropyrrolidin-3-yl)acetamide;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-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride?
The IUPAC name of 2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride (CID 175377016) is 2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride is Cl.NC(=O)CC1CNCC1(F)F.
What is the InChIKey of 2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride?
The InChIKey is IXTXHGWIUYBIKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2N2O.ClH/c7-6(8)3-10-2-4(6)1-5(9)11;/h4,10H,1-3H2,(H2,9,11);1H.
What are the key properties of 2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride?
2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride has a molecular weight of 200.62 g/mol, XLogP of 0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-difluoropyrrolidin-3-yl)acetamide;hydrochloride is sourced from PubChem (CID 175377016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).