7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine

C32H26N2 — CID 102517091

IUPAC7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine
SMILESCc1ccn2c(/C=C/c3c(-c4ccccc4)cc4cc(C)ccn34)c(-c3ccccc3)cc2c1
InChIInChI=1S/C32H26N2/c1-23-15-17-33-27(19-23)21-29(25-9-5-3-6-10-25)31(33)13-14-32-30(26-11-7-4-8-12-26)22-28-20-24(2)16-18-34(28)32/h3-22H,1-2H3/b14-13+
InChIKeyBKLWFHHYXMVANK-BUHFOSPRSA-N
MW438.57 g/mol
LogP8.31
Rot. Bonds4

About 7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine

7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine (PubChem CID 102517091) has the molecular formula C32H26N2 and a molecular weight of 438.57 g/mol. Its IUPAC name is 7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine.

Molecular Properties

Compound Name7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine
PubChem CID102517091
Molecular FormulaC32H26N2
Molecular Weight438.57 g/mol
Exact Mass438.21
IUPAC Name7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine
SMILESCc1ccn2c(/C=C/c3c(-c4ccccc4)cc4cc(C)ccn34)c(-c3ccccc3)cc2c1
InChIInChI=1S/C32H26N2/c1-23-15-17-33-27(19-23)21-29(25-9-5-3-6-10-25)31(33)13-14-32-30(26-11-7-4-8-12-26)22-28-20-24(2)16-18-34(28)32/h3-22H,1-2H3/b14-13+
InChIKeyBKLWFHHYXMVANK-BUHFOSPRSA-N
XLogP8.31
TPSA8.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.57
LogP ≤ 58.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine 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

3,3'-Diindolylmethane
CID 3071
Latrepirdine
CID 197033
Mebhydrolin
CID 22530
Decussine
CID 156336
2-[2,2-bis(1H-indol-3-yl)ethyl]aniline
CID 236191
Isocryptolepine
CID 380925
9-(4'-Aminophenyl)-9H-pyrido(3,4-b)indole
CID 154224
NOP agonist-2
CID 129188443
1-methyl-N,N-dimethyltryptamine
CID 25927
2-Phenylindolizine
CID 96128
4,4'-Diphenyl-2,2'-bipyridine
CID 80259
Cryptocyanin
CID 5351156

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine?
The IUPAC name of 7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine (CID 102517091) is 7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine.
What is the SMILES notation for 7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine?
The canonical SMILES for 7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine is Cc1ccn2c(/C=C/c3c(-c4ccccc4)cc4cc(C)ccn34)c(-c3ccccc3)cc2c1.
What is the InChIKey of 7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine?
The InChIKey is BKLWFHHYXMVANK-BUHFOSPRSA-N. The full InChI is InChI=1S/C32H26N2/c1-23-15-17-33-27(19-23)21-29(25-9-5-3-6-10-25)31(33)13-14-32-30(26-11-7-4-8-12-26)22-28-20-24(2)16-18-34(28)32/h3-22H,1-2H3/b14-13+.
What are the key properties of 7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine?
7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine has a molecular weight of 438.57 g/mol, XLogP of 8.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-[(E)-2-(7-methyl-2-phenylindolizin-3-yl)ethenyl]-2-phenylindolizine is sourced from PubChem (CID 102517091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).