N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide

C24H22N2O2 — CID 7354608

IUPACN-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide
SMILESCOc1ccc2[nH]cc(CCNC(=O)c3ccc(-c4ccccc4)cc3)c2c1
InChIInChI=1S/C24H22N2O2/c1-28-21-11-12-23-22(15-21)20(16-26-23)13-14-25-24(27)19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,15-16,26H,13-14H2,1H3,(H,25,27)
InChIKeyDSZNGEKRTSTCNN-UHFFFAOYSA-N
MW370.45 g/mol
LogP4.82
Rot. Bonds6

About N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide

N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide (PubChem CID 7354608) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide.

Molecular Properties

Compound NameN-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide
PubChem CID7354608
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC NameN-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide
SMILESCOc1ccc2[nH]cc(CCNC(=O)c3ccc(-c4ccccc4)cc3)c2c1
InChIInChI=1S/C24H22N2O2/c1-28-21-11-12-23-22(15-21)20(16-26-23)13-14-25-24(27)19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,15-16,26H,13-14H2,1H3,(H,25,27)
InChIKeyDSZNGEKRTSTCNN-UHFFFAOYSA-N
XLogP4.82
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide?
The IUPAC name of N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide (CID 7354608) is N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide.
What is the SMILES notation for N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide?
The canonical SMILES for N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide is COc1ccc2[nH]cc(CCNC(=O)c3ccc(-c4ccccc4)cc3)c2c1.
What is the InChIKey of N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide?
The InChIKey is DSZNGEKRTSTCNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O2/c1-28-21-11-12-23-22(15-21)20(16-26-23)13-14-25-24(27)19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-12,15-16,26H,13-14H2,1H3,(H,25,27).
What are the key properties of N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide?
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide has a molecular weight of 370.45 g/mol, XLogP of 4.82, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-phenylbenzamide is sourced from PubChem (CID 7354608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).