2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine

C9H9F3N2 — CID 146506428

IUPAC2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine
SMILESCN1Cc2cncc(C(F)(F)F)c2C1
InChIInChI=1S/C9H9F3N2/c1-14-4-6-2-13-3-8(7(6)5-14)9(10,11)12/h2-3H,4-5H2,1H3
InChIKeyHRNHFKIGZMTGIE-UHFFFAOYSA-N
MW202.18 g/mol
LogP2.05
Rot. Bonds

About 2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine

2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine (PubChem CID 146506428) has the molecular formula C9H9F3N2 and a molecular weight of 202.18 g/mol. Its IUPAC name is 2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine.

Molecular Properties

Compound Name2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine
PubChem CID146506428
Molecular FormulaC9H9F3N2
Molecular Weight202.18 g/mol
Exact Mass202.07
IUPAC Name2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine
SMILESCN1Cc2cncc(C(F)(F)F)c2C1
InChIInChI=1S/C9H9F3N2/c1-14-4-6-2-13-3-8(7(6)5-14)9(10,11)12/h2-3H,4-5H2,1H3
InChIKeyHRNHFKIGZMTGIE-UHFFFAOYSA-N
XLogP2.05
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.18
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine 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-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine?
The IUPAC name of 2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine (CID 146506428) is 2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine.
What is the SMILES notation for 2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine?
The canonical SMILES for 2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine is CN1Cc2cncc(C(F)(F)F)c2C1.
What is the InChIKey of 2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine?
The InChIKey is HRNHFKIGZMTGIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F3N2/c1-14-4-6-2-13-3-8(7(6)5-14)9(10,11)12/h2-3H,4-5H2,1H3.
What are the key properties of 2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine?
2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine has a molecular weight of 202.18 g/mol, XLogP of 2.05, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-(trifluoromethyl)-1,3-dihydropyrrolo[3,4-c]pyridine is sourced from PubChem (CID 146506428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).