2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole

C9H11F3N2 — CID 71732548

IUPAC2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole
SMILESFC(F)(F)C1(c2ccc[nH]2)CCCN1
InChIInChI=1S/C9H11F3N2/c10-9(11,12)8(4-2-6-14-8)7-3-1-5-13-7/h1,3,5,13-14H,2,4,6H2
InChIKeyASNVVOVSDYOJCM-UHFFFAOYSA-N
MW204.19 g/mol
LogP2.16
Rot. Bonds1

About 2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole

2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole (PubChem CID 71732548) has the molecular formula C9H11F3N2 and a molecular weight of 204.19 g/mol. Its IUPAC name is 2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole.

Molecular Properties

Compound Name2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole
PubChem CID71732548
Molecular FormulaC9H11F3N2
Molecular Weight204.19 g/mol
Exact Mass204.09
IUPAC Name2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole
SMILESFC(F)(F)C1(c2ccc[nH]2)CCCN1
InChIInChI=1S/C9H11F3N2/c10-9(11,12)8(4-2-6-14-8)7-3-1-5-13-7/h1,3,5,13-14H,2,4,6H2
InChIKeyASNVVOVSDYOJCM-UHFFFAOYSA-N
XLogP2.16
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole 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-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole?
The IUPAC name of 2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole (CID 71732548) is 2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole.
What is the SMILES notation for 2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole?
The canonical SMILES for 2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole is FC(F)(F)C1(c2ccc[nH]2)CCCN1.
What is the InChIKey of 2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole?
The InChIKey is ASNVVOVSDYOJCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F3N2/c10-9(11,12)8(4-2-6-14-8)7-3-1-5-13-7/h1,3,5,13-14H,2,4,6H2.
What are the key properties of 2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole?
2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole has a molecular weight of 204.19 g/mol, XLogP of 2.16, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-pyrrole is sourced from PubChem (CID 71732548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).