3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine

C10H6ClF3N2 — CID 671586

IUPAC3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cnc(-n2cccc2)c(Cl)c1
InChIInChI=1S/C10H6ClF3N2/c11-8-5-7(10(12,13)14)6-15-9(8)16-3-1-2-4-16/h1-6H
InChIKeyVTPAUOGNKCCAMU-UHFFFAOYSA-N
MW246.62 g/mol
LogP3.54
Rot. Bonds1

About 3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine

3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine (PubChem CID 671586) has the molecular formula C10H6ClF3N2 and a molecular weight of 246.62 g/mol. Its IUPAC name is 3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine
PubChem CID671586
Molecular FormulaC10H6ClF3N2
Molecular Weight246.62 g/mol
Exact Mass246.02
IUPAC Name3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cnc(-n2cccc2)c(Cl)c1
InChIInChI=1S/C10H6ClF3N2/c11-8-5-7(10(12,13)14)6-15-9(8)16-3-1-2-4-16/h1-6H
InChIKeyVTPAUOGNKCCAMU-UHFFFAOYSA-N
XLogP3.54
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.62
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine 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

Imidacloprid guanidine olefin
CID 9815679
3-Chloro-5-(trifluoromethyl)-2-pyridinamine
CID 607248
2-(1H-imidazol-1-yl)-5-(trifluoromethyl)pyridine
CID 737967
2-chloro-5-(1H-imidazol-1-ylmethyl)pyridine
CID 1473524
1-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)-1,4-diazepane
CID 735734
2-chloro-5-[(2-methyl-1H-imidazol-1-yl)methyl]pyridine
CID 3835786
N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thiourea
CID 1483750
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N,N-dimethyl-1H-pyrrole-2-sulfonamide
CID 3798543
1-(6-Chloro-3-pyridyl)methyl-2-iminopyrrolidine
CID 9794312
5-[(E)-2-(2-chloro-6-fluorophenyl)ethenyl]-N,N-dimethylpyridin-2-amine
CID 118707602
3,5-Dichloro-2-(triazol-1-yl)-4-(trifluoromethyl)pyridine
CID 146438049
4-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)thiomorpholine
CID 2821299

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine?
The IUPAC name of 3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine (CID 671586) is 3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine?
The canonical SMILES for 3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine is FC(F)(F)c1cnc(-n2cccc2)c(Cl)c1.
What is the InChIKey of 3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine?
The InChIKey is VTPAUOGNKCCAMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClF3N2/c11-8-5-7(10(12,13)14)6-15-9(8)16-3-1-2-4-16/h1-6H.
What are the key properties of 3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine?
3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine has a molecular weight of 246.62 g/mol, XLogP of 3.54, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-pyrrol-1-yl-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 671586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).