1-benzyl-2-oxo-3H-indole-5-carboxamide

C16H14N2O2 — CID 122479775

IUPAC1-benzyl-2-oxo-3H-indole-5-carboxamide
SMILESNC(=O)c1ccc2c(c1)CC(=O)N2Cc1ccccc1
InChIInChI=1S/C16H14N2O2/c17-16(20)12-6-7-14-13(8-12)9-15(19)18(14)10-11-4-2-1-3-5-11/h1-8H,9-10H2,(H2,17,20)
InChIKeyMTINYQMJOPIKKO-UHFFFAOYSA-N
MW266.30 g/mol
LogP1.87
Rot. Bonds3

About 1-benzyl-2-oxo-3H-indole-5-carboxamide

1-benzyl-2-oxo-3H-indole-5-carboxamide (PubChem CID 122479775) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 1-benzyl-2-oxo-3H-indole-5-carboxamide.

Molecular Properties

Compound Name1-benzyl-2-oxo-3H-indole-5-carboxamide
PubChem CID122479775
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name1-benzyl-2-oxo-3H-indole-5-carboxamide
SMILESNC(=O)c1ccc2c(c1)CC(=O)N2Cc1ccccc1
InChIInChI=1S/C16H14N2O2/c17-16(20)12-6-7-14-13(8-12)9-15(19)18(14)10-11-4-2-1-3-5-11/h1-8H,9-10H2,(H2,17,20)
InChIKeyMTINYQMJOPIKKO-UHFFFAOYSA-N
XLogP1.87
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-2-oxo-N-propan-2-yl-3H-indole-5-carboxamide
CID 71840675
1-benzyl-N-cyclopropyl-2-oxo-3H-indole-5-carboxamide
CID 53160635
5-acetyl-1-[(4-aminophenyl)methyl]-3H-indol-2-one
CID 84758268
4-[(5-acetyl-2-oxo-3H-indol-1-yl)methyl]benzoic acid
CID 84758253
1-benzyl-2-oxo-N-[[(2R)-oxolan-2-yl]methyl]-3H-indole-5-carboxamide
CID 95100034
1-benzyl-N-[1-(4-fluorophenyl)ethyl]-2-oxo-3H-indole-5-carboxamide
CID 71840648
1-(2-amino-2-oxoethyl)-2-oxo-3H-indole-5-carboxylic acid
CID 102711155
N,1-bis[(4-fluorophenyl)methyl]-2-oxo-3H-indole-5-carboxamide
CID 71840635
1-benzyl-6-(piperidine-1-carbonyl)-3,4-dihydroquinolin-2-one
CID 53135752
N-[(3,5-difluorophenyl)methyl]-1-[(3-fluorophenyl)methyl]-2-oxo-3H-indole-5-carboxamide
CID 71840611
1-[(3-amino-4-chlorophenyl)methyl]-3H-indol-2-one
CID 43349881
1-methyl-5-(2-phenylacetyl)-3H-indol-2-one
CID 43339443

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2-oxo-3H-indole-5-carboxamide?
The IUPAC name of 1-benzyl-2-oxo-3H-indole-5-carboxamide (CID 122479775) is 1-benzyl-2-oxo-3H-indole-5-carboxamide.
What is the SMILES notation for 1-benzyl-2-oxo-3H-indole-5-carboxamide?
The canonical SMILES for 1-benzyl-2-oxo-3H-indole-5-carboxamide is NC(=O)c1ccc2c(c1)CC(=O)N2Cc1ccccc1.
What is the InChIKey of 1-benzyl-2-oxo-3H-indole-5-carboxamide?
The InChIKey is MTINYQMJOPIKKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c17-16(20)12-6-7-14-13(8-12)9-15(19)18(14)10-11-4-2-1-3-5-11/h1-8H,9-10H2,(H2,17,20).
What are the key properties of 1-benzyl-2-oxo-3H-indole-5-carboxamide?
1-benzyl-2-oxo-3H-indole-5-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2-oxo-3H-indole-5-carboxamide is sourced from PubChem (CID 122479775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).