3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide

C16H13NO2 — CID 154839553

IUPAC3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide
SMILESO=C1CC(C(=O)Nc2ccccc2)c2ccccc21
InChIInChI=1S/C16H13NO2/c18-15-10-14(12-8-4-5-9-13(12)15)16(19)17-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,17,19)
InChIKeyMSOYDQRMGMXZAB-UHFFFAOYSA-N
MW251.29 g/mol
LogP3.00
Rot. Bonds2

About 3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide

3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide (PubChem CID 154839553) has the molecular formula C16H13NO2 and a molecular weight of 251.29 g/mol. Its IUPAC name is 3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide.

Molecular Properties

Compound Name3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide
PubChem CID154839553
Molecular FormulaC16H13NO2
Molecular Weight251.29 g/mol
Exact Mass251.09
IUPAC Name3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide
SMILESO=C1CC(C(=O)Nc2ccccc2)c2ccccc21
InChIInChI=1S/C16H13NO2/c18-15-10-14(12-8-4-5-9-13(12)15)16(19)17-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,17,19)
InChIKeyMSOYDQRMGMXZAB-UHFFFAOYSA-N
XLogP3.00
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-[methyl-(3-oxo-1,2-dihydroindene-1-carbonyl)amino]phenyl]-3-oxo-1,2-dihydroindene-1-carboxamide
CID 146089982
N-(2-methylsulfanylphenyl)-3-oxo-1,2-dihydroindene-1-carboxamide
CID 45497074
2-oxo-N-phenyl-3,4-dihydro-1H-quinoline-4-carboxamide
CID 17493174
N-(4-aminocyclohexyl)-3-oxo-1,2-dihydroindene-1-carboxamide
CID 163878708
N-(4-hydroxyphenyl)bicyclo[4.2.0]octa-1,3,5-triene-7-carboxamide
CID 66396911
N-[4-(dimethylamino)phenyl]-7-methyl-3-oxo-1,2-dihydroindene-1-carboxamide
CID 110677636
2,5-dioxo-N-phenylcyclopentane-1-carboxamide
CID 75388196
(3R)-1-oxo-N-phenyl-3,4-dihydroisochromene-3-carboxamide
CID 2146542
N-(2,4-dimethyl-6-oxo-1-pyridinyl)-3-oxo-1,2-dihydroindene-1-carboxamide
CID 56759396
N-phenyl-2,3-dihydro-1H-indene-2-carboxamide
CID 112520410
5,5-dimethyl-2-oxo-N-phenyloxolane-3-carboxamide
CID 3473493
N-[3-(1-benzofuran-2-yl)-1H-indazol-5-yl]-3-oxo-1,2-dihydroindene-1-carboxamide
CID 23589912

Frequently Asked Questions

What is the IUPAC name of 3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide?
The IUPAC name of 3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide (CID 154839553) is 3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide.
What is the SMILES notation for 3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide?
The canonical SMILES for 3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide is O=C1CC(C(=O)Nc2ccccc2)c2ccccc21.
What is the InChIKey of 3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide?
The InChIKey is MSOYDQRMGMXZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO2/c18-15-10-14(12-8-4-5-9-13(12)15)16(19)17-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,17,19).
What are the key properties of 3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide?
3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide has a molecular weight of 251.29 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-oxo-N-phenyl-1,2-dihydroindene-1-carboxamide is sourced from PubChem (CID 154839553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).