N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide

C24H21N3O — CID 112986190

IUPACN-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)Nc1ccc(N2CCc3ccccc32)cc1
InChIInChI=1S/C24H21N3O/c28-24(15-18-16-25-22-7-3-2-6-21(18)22)26-19-9-11-20(12-10-19)27-14-13-17-5-1-4-8-23(17)27/h1-12,16,25H,13-15H2,(H,26,28)
InChIKeyNQWDTQLKHYMNMG-UHFFFAOYSA-N
MW367.45 g/mol
LogP5.04
Rot. Bonds4

About N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide

N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide (PubChem CID 112986190) has the molecular formula C24H21N3O and a molecular weight of 367.45 g/mol. Its IUPAC name is N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide
PubChem CID112986190
Molecular FormulaC24H21N3O
Molecular Weight367.45 g/mol
Exact Mass367.17
IUPAC NameN-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)Nc1ccc(N2CCc3ccccc32)cc1
InChIInChI=1S/C24H21N3O/c28-24(15-18-16-25-22-7-3-2-6-21(18)22)26-19-9-11-20(12-10-19)27-14-13-17-5-1-4-8-23(17)27/h1-12,16,25H,13-15H2,(H,26,28)
InChIKeyNQWDTQLKHYMNMG-UHFFFAOYSA-N
XLogP5.04
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.45
LogP ≤ 55.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(4-sulfamoylphenyl)acetamide
CID 56553200
N-(4-bromophenyl)-2-(1H-indol-3-yl)acetamide
CID 2093840
2-(1H-indol-3-yl)-N-[4-(3-methylmorpholin-4-yl)phenyl]acetamide
CID 110637394
2-(1H-indol-3-yl)-N-[4-(3-methylpiperidin-1-yl)phenyl]acetamide
CID 112985524
N-[4-(cyclopropanecarbonyl)phenyl]-2-(1H-indol-3-yl)acetamide
CID 110604202
N-(3,4-dihydroxyphenyl)-2-(1H-indol-3-yl)acetamide
CID 170716792
4-(1H-indol-3-yl)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]butanamide
CID 46680700
N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-ethylbutanamide
CID 112986176
2-(1H-indol-3-yl)-N-[4-(4-methylmorpholin-2-yl)phenyl]acetamide
CID 110743293
N-[4-(2,3-dihydroindol-1-yl)phenyl]cyclobutanecarboxamide
CID 112986213
2-(1H-indol-3-yl)-N-[4-[(S)-trifluoromethylsulfinyl]phenyl]acetamide
CID 95785414
2-(1H-indol-3-yl)-N-[4-[(1-methylpyrrolidin-2-ylidene)amino]sulfonylphenyl]acetamide
CID 51956796

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide?
The IUPAC name of N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide (CID 112986190) is N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide.
What is the SMILES notation for N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide?
The canonical SMILES for N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide is O=C(Cc1c[nH]c2ccccc12)Nc1ccc(N2CCc3ccccc32)cc1.
What is the InChIKey of N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide?
The InChIKey is NQWDTQLKHYMNMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O/c28-24(15-18-16-25-22-7-3-2-6-21(18)22)26-19-9-11-20(12-10-19)27-14-13-17-5-1-4-8-23(17)27/h1-12,16,25H,13-15H2,(H,26,28).
What are the key properties of N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide?
N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide has a molecular weight of 367.45 g/mol, XLogP of 5.04, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-(1H-indol-3-yl)acetamide is sourced from PubChem (CID 112986190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).