(3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride

C7H12ClF3N2O — CID 67294107

IUPAC(3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCl.O=C(NCC(F)(F)F)[C@@H]1CCNC1
InChIInChI=1S/C7H11F3N2O.ClH/c8-7(9,10)4-12-6(13)5-1-2-11-3-5;/h5,11H,1-4H2,(H,12,13);1H/t5-;/m1./s1
InChIKeyZYWBNTIOVKGLSG-NUBCRITNSA-N
MW232.63 g/mol
LogP0.70
Rot. Bonds2

About (3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride

(3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride (PubChem CID 67294107) has the molecular formula C7H12ClF3N2O and a molecular weight of 232.63 g/mol. Its IUPAC name is (3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name(3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride
PubChem CID67294107
Molecular FormulaC7H12ClF3N2O
Molecular Weight232.63 g/mol
Exact Mass232.06
IUPAC Name(3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCl.O=C(NCC(F)(F)F)[C@@H]1CCNC1
InChIInChI=1S/C7H11F3N2O.ClH/c8-7(9,10)4-12-6(13)5-1-2-11-3-5;/h5,11H,1-4H2,(H,12,13);1H/t5-;/m1./s1
InChIKeyZYWBNTIOVKGLSG-NUBCRITNSA-N
XLogP0.70
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.63
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;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

5-Oxopyrrolidine-3-carboxamide
CID 3528514
4-(Aminomethyl)pyrrolidin-2-one
CID 19757933
N-Methylpyrrolidine-3-carboxamide
CID 23090433
4-(Aminomethyl)pyrrolidin-2-one hydrochloride
CID 67126653
3-(Aminomethyl)pyrrolidin-2-one
CID 19694998
(3R)-N-methylpyrrolidine-3-carboxamide
CID 28280630
Pyrrolidine-3-carboxamide hydrochloride
CID 50988639
N,N-dimethylpyrrolidine-3-carboxamide hydrochloride
CID 67043737
4-(Trifluoromethyl)pyrrolidin-2-one
CID 67195107
4-(Difluoromethyl)pyrrolidin-2-one
CID 67253829
(3S)-N,N-dimethyl-3-pyrrolidinecarboxamide hydrochloride
CID 67293927
(S)-Pyrrolidine-3-carboxamide hydrochloride
CID 68627577

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride?
The IUPAC name of (3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride (CID 67294107) is (3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride.
What is the SMILES notation for (3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride?
The canonical SMILES for (3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride is Cl.O=C(NCC(F)(F)F)[C@@H]1CCNC1.
What is the InChIKey of (3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride?
The InChIKey is ZYWBNTIOVKGLSG-NUBCRITNSA-N. The full InChI is InChI=1S/C7H11F3N2O.ClH/c8-7(9,10)4-12-6(13)5-1-2-11-3-5;/h5,11H,1-4H2,(H,12,13);1H/t5-;/m1./s1.
What are the key properties of (3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride?
(3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride has a molecular weight of 232.63 g/mol, XLogP of 0.70, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 67294107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).