N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide

C17H15N3O3 — CID 108797946

IUPACN-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
SMILESNC(=O)c1ccc(CNC(=O)c2ccc3c(c2)CC(=O)N3)cc1
InChIInChI=1S/C17H15N3O3/c18-16(22)11-3-1-10(2-4-11)9-19-17(23)12-5-6-14-13(7-12)8-15(21)20-14/h1-7H,8-9H2,(H2,18,22)(H,19,23)(H,20,21)
InChIKeyLJEHLTVQVCWFNG-UHFFFAOYSA-N
MW309.33 g/mol
LogP1.21
Rot. Bonds4

About N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide

N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide (PubChem CID 108797946) has the molecular formula C17H15N3O3 and a molecular weight of 309.33 g/mol. Its IUPAC name is N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide.

Molecular Properties

Compound NameN-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
PubChem CID108797946
Molecular FormulaC17H15N3O3
Molecular Weight309.33 g/mol
Exact Mass309.11
IUPAC NameN-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
SMILESNC(=O)c1ccc(CNC(=O)c2ccc3c(c2)CC(=O)N3)cc1
InChIInChI=1S/C17H15N3O3/c18-16(22)11-3-1-10(2-4-11)9-19-17(23)12-5-6-14-13(7-12)8-15(21)20-14/h1-7H,8-9H2,(H2,18,22)(H,19,23)(H,20,21)
InChIKeyLJEHLTVQVCWFNG-UHFFFAOYSA-N
XLogP1.21
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 51.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 11346996
3,4-dimethyl-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]benzamide
CID 110781303
N-[[4-[(2-amino-2-oxoethyl)carbamoyl]phenyl]methyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 46494287
N-(2-hydroxyethyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 18765684
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 115271278
2-oxo-N-[(1-propan-2-ylcyclopropyl)methyl]-1,3-dihydroindole-5-carboxamide
CID 103742618
N-[(4-hydroxyoxan-4-yl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 103712064
N-(1,2-oxazol-3-ylmethyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 103721386
N-(2-amino-2-oxoethoxy)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 103901262
methyl 2-[(2-oxo-1,3-dihydroindole-5-carbonyl)amino]acetate
CID 83724913
N-(2-hydroxypropyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 108784707
2-oxo-N-(pyridin-4-ylmethyl)-3,4-dihydro-1H-quinoline-6-carboxamide
CID 18107678

Frequently Asked Questions

What is the IUPAC name of N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide?
The IUPAC name of N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide (CID 108797946) is N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide.
What is the SMILES notation for N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide?
The canonical SMILES for N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide is NC(=O)c1ccc(CNC(=O)c2ccc3c(c2)CC(=O)N3)cc1.
What is the InChIKey of N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide?
The InChIKey is LJEHLTVQVCWFNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3/c18-16(22)11-3-1-10(2-4-11)9-19-17(23)12-5-6-14-13(7-12)8-15(21)20-14/h1-7H,8-9H2,(H2,18,22)(H,19,23)(H,20,21).
What are the key properties of N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide?
N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide has a molecular weight of 309.33 g/mol, XLogP of 1.21, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide is sourced from PubChem (CID 108797946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).