(2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide

C6H10F2N2O — CID 57420322

IUPAC(2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide
SMILESNC(=O)[C@]1(C(F)F)CCCN1
InChIInChI=1S/C6H10F2N2O/c7-4(8)6(5(9)11)2-1-3-10-6/h4,10H,1-3H2,(H2,9,11)/t6-/m1/s1
InChIKeyVKXBVSPUZSWKJQ-ZCFIWIBFSA-N
MW164.16 g/mol
LogP-0.14
Rot. Bonds2

About (2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide

(2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide (PubChem CID 57420322) has the molecular formula C6H10F2N2O and a molecular weight of 164.16 g/mol. Its IUPAC name is (2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide
PubChem CID57420322
Molecular FormulaC6H10F2N2O
Molecular Weight164.16 g/mol
Exact Mass164.08
IUPAC Name(2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide
SMILESNC(=O)[C@]1(C(F)F)CCCN1
InChIInChI=1S/C6H10F2N2O/c7-4(8)6(5(9)11)2-1-3-10-6/h4,10H,1-3H2,(H2,9,11)/t6-/m1/s1
InChIKeyVKXBVSPUZSWKJQ-ZCFIWIBFSA-N
XLogP-0.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide 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 (2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide (CID 57420322) is (2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide is NC(=O)[C@]1(C(F)F)CCCN1.
What is the InChIKey of (2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide?
The InChIKey is VKXBVSPUZSWKJQ-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H10F2N2O/c7-4(8)6(5(9)11)2-1-3-10-6/h4,10H,1-3H2,(H2,9,11)/t6-/m1/s1.
What are the key properties of (2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide?
(2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide has a molecular weight of 164.16 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 (2S)-2-(difluoromethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 57420322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).