1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole

C11H14N2 — CID 6424797

IUPAC1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole
SMILESCn1cccc1Cc1cccn1C
InChIInChI=1S/C11H14N2/c1-12-7-3-5-10(12)9-11-6-4-8-13(11)2/h3-8H,9H2,1-2H3
InChIKeyGIRSHINZLWWKIV-UHFFFAOYSA-N
MW174.25 g/mol
LogP1.95
Rot. Bonds2

About 1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole

1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole (PubChem CID 6424797) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole.

Molecular Properties

Compound Name1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole
PubChem CID6424797
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole
SMILESCn1cccc1Cc1cccn1C
InChIInChI=1S/C11H14N2/c1-12-7-3-5-10(12)9-11-6-4-8-13(11)2/h3-8H,9H2,1-2H3
InChIKeyGIRSHINZLWWKIV-UHFFFAOYSA-N
XLogP1.95
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-methyl-2-[(1-methylpyrrol-2-yl)methyl]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 1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole?
The IUPAC name of 1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole (CID 6424797) is 1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole.
What is the SMILES notation for 1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole?
The canonical SMILES for 1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole is Cn1cccc1Cc1cccn1C.
What is the InChIKey of 1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole?
The InChIKey is GIRSHINZLWWKIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-12-7-3-5-10(12)9-11-6-4-8-13(11)2/h3-8H,9H2,1-2H3.
What are the key properties of 1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole?
1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole has a molecular weight of 174.25 g/mol, XLogP of 1.95, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[(1-methylpyrrol-2-yl)methyl]pyrrole is sourced from PubChem (CID 6424797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).