3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide

C17H16N2O2 — CID 14624056

IUPAC3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide
SMILESCC1(C)C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc21
InChIInChI=1S/C17H16N2O2/c1-17(2)13-9-8-11(10-14(13)19-16(17)21)15(20)18-12-6-4-3-5-7-12/h3-10H,1-2H3,(H,18,20)(H,19,21)
InChIKeyMVWLRDGGFSZGJT-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.17
Rot. Bonds2

About 3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide

3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide (PubChem CID 14624056) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide.

Molecular Properties

Compound Name3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide
PubChem CID14624056
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide
SMILESCC1(C)C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc21
InChIInChI=1S/C17H16N2O2/c1-17(2)13-9-8-11(10-14(13)19-16(17)21)15(20)18-12-6-4-3-5-7-12/h3-10H,1-2H3,(H,18,20)(H,19,21)
InChIKeyMVWLRDGGFSZGJT-UHFFFAOYSA-N
XLogP3.17
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chlorophenyl)-3,3-dimethyl-2-oxo-1H-indole-6-carboxamide
CID 14856608
N-(4-ethoxyphenyl)-3,3-dimethyl-2-oxo-1H-indole-6-carboxamide
CID 57261046
N-benzyl-3,3-dimethyl-2-oxo-1H-indole-6-carboxamide
CID 138993218
N-(4-hydroxy-2-methylphenyl)-3,3-dimethyl-2-oxo-1H-indole-6-carboxamide
CID 19832367
3,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1H-indole-6-carboxamide
CID 19832303
N-(2,4-diaminophenyl)-3,3-dimethyl-2-oxo-1H-indole-6-carboxamide
CID 19832350
3-(7,7-dimethyl-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-N-phenyl-1H-indazole-5-carboxamide
CID 135466545
N-(furan-2-ylmethyl)-3,3-dimethyl-2-oxo-1H-indole-6-carboxamide
CID 142502464
3,4-dichloro-N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)benzamide
CID 110405719
N-(3,3-dimethyl-2-oxo-1H-indol-6-yl)thiadiazole-4-carboxamide
CID 14476428
3,3-dimethyl-2-oxo-N-phenyl-1-propylindole-6-carboxamide
CID 19832370
1,3-dioxo-N-phenylisoindole-5-carboxamide
CID 22001655

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide?
The IUPAC name of 3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide (CID 14624056) is 3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide.
What is the SMILES notation for 3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide?
The canonical SMILES for 3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide is CC1(C)C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc21.
What is the InChIKey of 3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide?
The InChIKey is MVWLRDGGFSZGJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-17(2)13-9-8-11(10-14(13)19-16(17)21)15(20)18-12-6-4-3-5-7-12/h3-10H,1-2H3,(H,18,20)(H,19,21).
What are the key properties of 3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide?
3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 3.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-2-oxo-N-phenyl-1H-indole-6-carboxamide is sourced from PubChem (CID 14624056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).