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

C17H16N2O3 — CID 11346996

IUPACN-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc3c(c2)CC(=O)N3)cc1
InChIInChI=1S/C17H16N2O3/c1-22-14-5-2-11(3-6-14)10-18-17(21)12-4-7-15-13(8-12)9-16(20)19-15/h2-8H,9-10H2,1H3,(H,18,21)(H,19,20)
InChIKeyVQHUCMCIWMZMDP-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.12
Rot. Bonds4

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

N-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide (PubChem CID 11346996) has the molecular formula C17H16N2O3 and a molecular weight of 296.33 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
PubChem CID11346996
Molecular FormulaC17H16N2O3
Molecular Weight296.33 g/mol
Exact Mass296.12
IUPAC NameN-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc3c(c2)CC(=O)N3)cc1
InChIInChI=1S/C17H16N2O3/c1-22-14-5-2-11(3-6-14)10-18-17(21)12-4-7-15-13(8-12)9-16(20)19-15/h2-8H,9-10H2,1H3,(H,18,21)(H,19,20)
InChIKeyVQHUCMCIWMZMDP-UHFFFAOYSA-N
XLogP2.12
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-carbamoylphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 108797946
5-[2-(4-methoxyphenyl)acetyl]-1,3-dihydroindol-2-one
CID 43338604
3,4-dimethyl-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]benzamide
CID 110781303
methyl 2-[(2-oxo-1,3-dihydroindole-5-carbonyl)amino]acetate
CID 83724913
3,5-dimethoxy-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzamide
CID 110788429
N-[(4-methoxyphenyl)methyl]naphthalene-2-carboxamide
CID 883831
N-[3-(methylamino)propyl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 69247393
N-[(3,3-dimethyl-2-oxo-1H-indol-5-yl)methyl]-4-methoxybenzamide
CID 110784000
N-(2-hydroxyethyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 18765684
N-(2-hydroxypropyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 108784707
N-[(6-methoxy-3-pyridinyl)methyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 24613235
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 103800042

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide (CID 11346996) is N-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide is COc1ccc(CNC(=O)c2ccc3c(c2)CC(=O)N3)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide?
The InChIKey is VQHUCMCIWMZMDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O3/c1-22-14-5-2-11(3-6-14)10-18-17(21)12-4-7-15-13(8-12)9-16(20)19-15/h2-8H,9-10H2,1H3,(H,18,21)(H,19,20).
What are the key properties of N-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide?
N-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide has a molecular weight of 296.33 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-2-oxo-1,3-dihydroindole-5-carboxamide is sourced from PubChem (CID 11346996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).