1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole

C15H22N2 — CID 15707389

IUPAC1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole
SMILESCc1cc(C)n(C)c1Cc1c(C)cc(C)n1C
InChIInChI=1S/C15H22N2/c1-10-7-12(3)16(5)14(10)9-15-11(2)8-13(4)17(15)6/h7-8H,9H2,1-6H3
InChIKeyKCSCOAINENSNNV-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.19
Rot. Bonds2

About 1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole

1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole (PubChem CID 15707389) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole.

Molecular Properties

Compound Name1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole
PubChem CID15707389
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole
SMILESCc1cc(C)n(C)c1Cc1c(C)cc(C)n1C
InChIInChI=1S/C15H22N2/c1-10-7-12(3)16(5)14(10)9-15-11(2)8-13(4)17(15)6/h7-8H,9H2,1-6H3
InChIKeyKCSCOAINENSNNV-UHFFFAOYSA-N
XLogP3.19
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-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 1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole?
The IUPAC name of 1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole (CID 15707389) is 1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole.
What is the SMILES notation for 1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole?
The canonical SMILES for 1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole is Cc1cc(C)n(C)c1Cc1c(C)cc(C)n1C.
What is the InChIKey of 1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole?
The InChIKey is KCSCOAINENSNNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-10-7-12(3)16(5)14(10)9-15-11(2)8-13(4)17(15)6/h7-8H,9H2,1-6H3.
What are the key properties of 1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole?
1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole has a molecular weight of 230.35 g/mol, XLogP of 3.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5-trimethyl-2-[(1,3,5-trimethylpyrrol-2-yl)methyl]pyrrole is sourced from PubChem (CID 15707389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).