N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide

C24H22N2O2 — CID 24760244

IUPACN-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide
SMILESCCn1c(-c2ccccc2)cc2cc(NC(=O)c3ccccc3OC)ccc21
InChIInChI=1S/C24H22N2O2/c1-3-26-21-14-13-19(25-24(27)20-11-7-8-12-23(20)28-2)15-18(21)16-22(26)17-9-5-4-6-10-17/h4-16H,3H2,1-2H3,(H,25,27)
InChIKeySDKKTWURBHYRNK-UHFFFAOYSA-N
MW370.45 g/mol
LogP5.59
Rot. Bonds5

About N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide

N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide (PubChem CID 24760244) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide.

Molecular Properties

Compound NameN-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide
PubChem CID24760244
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC NameN-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide
SMILESCCn1c(-c2ccccc2)cc2cc(NC(=O)c3ccccc3OC)ccc21
InChIInChI=1S/C24H22N2O2/c1-3-26-21-14-13-19(25-24(27)20-11-7-8-12-23(20)28-2)15-18(21)16-22(26)17-9-5-4-6-10-17/h4-16H,3H2,1-2H3,(H,25,27)
InChIKeySDKKTWURBHYRNK-UHFFFAOYSA-N
XLogP5.59
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.45
LogP ≤ 55.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide?
The IUPAC name of N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide (CID 24760244) is N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide.
What is the SMILES notation for N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide?
The canonical SMILES for N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide is CCn1c(-c2ccccc2)cc2cc(NC(=O)c3ccccc3OC)ccc21.
What is the InChIKey of N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide?
The InChIKey is SDKKTWURBHYRNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O2/c1-3-26-21-14-13-19(25-24(27)20-11-7-8-12-23(20)28-2)15-18(21)16-22(26)17-9-5-4-6-10-17/h4-16H,3H2,1-2H3,(H,25,27).
What are the key properties of N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide?
N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide has a molecular weight of 370.45 g/mol, XLogP of 5.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide is sourced from PubChem (CID 24760244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).