N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide

C22H18N2O2 — CID 108784603

IUPACN-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide
SMILESO=C1Cc2cc(C(=O)NC(c3ccccc3)c3ccccc3)ccc2N1
InChIInChI=1S/C22H18N2O2/c25-20-14-18-13-17(11-12-19(18)23-20)22(26)24-21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,21H,14H2,(H,23,25)(H,24,26)
InChIKeyOSHUEDCDXQJKKQ-UHFFFAOYSA-N
MW342.40 g/mol
LogP3.70
Rot. Bonds4

About N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide

N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide (PubChem CID 108784603) has the molecular formula C22H18N2O2 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide.

Molecular Properties

Compound NameN-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide
PubChem CID108784603
Molecular FormulaC22H18N2O2
Molecular Weight342.40 g/mol
Exact Mass342.14
IUPAC NameN-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide
SMILESO=C1Cc2cc(C(=O)NC(c3ccccc3)c3ccccc3)ccc2N1
InChIInChI=1S/C22H18N2O2/c25-20-14-18-13-17(11-12-19(18)23-20)22(26)24-21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,21H,14H2,(H,23,25)(H,24,26)
InChIKeyOSHUEDCDXQJKKQ-UHFFFAOYSA-N
XLogP3.70
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzhydryl-3-(2-oxo-1,3-dihydroindol-5-yl)urea
CID 30375491
N-(1,3-dihydroxypropan-2-yl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 113429194
3-cyclopropyl-3-[(2-oxo-1,3-dihydroindole-5-carbonyl)amino]propanoic acid
CID 102710846
N-(1,1-dimethoxypropan-2-yl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 102712430
2-[(2-oxo-1,3-dihydroindole-5-carbonyl)amino]pent-4-ynoic acid
CID 102710831
N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 24625536
2-oxo-N-pent-4-en-2-yl-1,3-dihydroindole-5-carboxamide
CID 113237405
N-[(4-chlorophenyl)-phenylmethyl]-3-oxo-4H-1,4-benzoxazine-7-carboxamide
CID 55372147
N-(4-methylhexan-2-yl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 103708354
[2-oxo-2-(2-oxo-1,3-dihydroindol-5-yl)ethyl] (2S)-2-benzamidopropanoate
CID 8753386
N-(1,2-diphenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 46564543
N-(2-hydroxyethyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 18765684

Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide?
The IUPAC name of N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide (CID 108784603) is N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide.
What is the SMILES notation for N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide?
The canonical SMILES for N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide is O=C1Cc2cc(C(=O)NC(c3ccccc3)c3ccccc3)ccc2N1.
What is the InChIKey of N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide?
The InChIKey is OSHUEDCDXQJKKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O2/c25-20-14-18-13-17(11-12-19(18)23-20)22(26)24-21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,21H,14H2,(H,23,25)(H,24,26).
What are the key properties of N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide?
N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide has a molecular weight of 342.40 g/mol, XLogP of 3.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-2-oxo-1,3-dihydroindole-5-carboxamide is sourced from PubChem (CID 108784603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).