(5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone

C23H24N4O2 — CID 24776345

IUPAC(5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone
SMILESCOc1ccc2[nH]c(C(=O)N3CCC(n4c(C)nc5ccccc54)CC3)cc2c1
InChIInChI=1S/C23H24N4O2/c1-15-24-20-5-3-4-6-22(20)27(15)17-9-11-26(12-10-17)23(28)21-14-16-13-18(29-2)7-8-19(16)25-21/h3-8,13-14,17,25H,9-12H2,1-2H3
InChIKeyCJFMJEUEUPHGHU-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.31
Rot. Bonds3

About (5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone

(5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone (PubChem CID 24776345) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is (5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone
PubChem CID24776345
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Name(5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone
SMILESCOc1ccc2[nH]c(C(=O)N3CCC(n4c(C)nc5ccccc54)CC3)cc2c1
InChIInChI=1S/C23H24N4O2/c1-15-24-20-5-3-4-6-22(20)27(15)17-9-11-26(12-10-17)23(28)21-14-16-13-18(29-2)7-8-19(16)25-21/h3-8,13-14,17,25H,9-12H2,1-2H3
InChIKeyCJFMJEUEUPHGHU-UHFFFAOYSA-N
XLogP4.31
TPSA63.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone 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 (5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone?
The IUPAC name of (5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone (CID 24776345) is (5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone.
What is the SMILES notation for (5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone?
The canonical SMILES for (5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone is COc1ccc2[nH]c(C(=O)N3CCC(n4c(C)nc5ccccc54)CC3)cc2c1.
What is the InChIKey of (5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone?
The InChIKey is CJFMJEUEUPHGHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-15-24-20-5-3-4-6-22(20)27(15)17-9-11-26(12-10-17)23(28)21-14-16-13-18(29-2)7-8-19(16)25-21/h3-8,13-14,17,25H,9-12H2,1-2H3.
What are the key properties of (5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone?
(5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone has a molecular weight of 388.47 g/mol, XLogP of 4.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-1H-indol-2-yl)-[4-(2-methylbenzimidazol-1-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 24776345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).