phenyl 2-oxo-3H-indole-1-carboxylate

C15H11NO3 — CID 15469893

IUPACphenyl 2-oxo-3H-indole-1-carboxylate
SMILESO=C1Cc2ccccc2N1C(=O)Oc1ccccc1
InChIInChI=1S/C15H11NO3/c17-14-10-11-6-4-5-9-13(11)16(14)15(18)19-12-7-2-1-3-8-12/h1-9H,10H2
InChIKeyORMJSGNKJURUQU-UHFFFAOYSA-N
MW253.26 g/mol
LogP2.77
Rot. Bonds1

About phenyl 2-oxo-3H-indole-1-carboxylate

phenyl 2-oxo-3H-indole-1-carboxylate (PubChem CID 15469893) has the molecular formula C15H11NO3 and a molecular weight of 253.26 g/mol. Its IUPAC name is phenyl 2-oxo-3H-indole-1-carboxylate.

Molecular Properties

Compound Namephenyl 2-oxo-3H-indole-1-carboxylate
PubChem CID15469893
Molecular FormulaC15H11NO3
Molecular Weight253.26 g/mol
Exact Mass253.07
IUPAC Namephenyl 2-oxo-3H-indole-1-carboxylate
SMILESO=C1Cc2ccccc2N1C(=O)Oc1ccccc1
InChIInChI=1S/C15H11NO3/c17-14-10-11-6-4-5-9-13(11)16(14)15(18)19-12-7-2-1-3-8-12/h1-9H,10H2
InChIKeyORMJSGNKJURUQU-UHFFFAOYSA-N
XLogP2.77
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,2-dichloroacetyl)-3H-indol-2-one
CID 11791397
phenyl benzo[b][1]benzazepine-11-carboxylate
CID 110168207
diphenyl 6H-benzo[d][1,3]benzodiazepine-5,7-dicarboxylate
CID 67223885
2-oxo-N-[4-(trifluoromethoxy)phenyl]-3H-indole-1-carboxamide
CID 118444181
CID 165088007
CID 165088007
9H-acridine-10-carbonyl chloride
CID 165358723
2-(2-oxo-3H-indol-1-yl)acetamide
CID 840219
tert-butyl 9H-acridine-10-carboxylate
CID 102499784
diphenyl diazinane-1,2-dicarboxylate
CID 139696788
phenyl 2-oxopiperidine-1-carboxylate
CID 10036365
ethane;5-oxo-6H-benzo[b][1]benzazepine-11-carboxamide
CID 143893495
phenyl 4-methyl-1,4-diazepane-1-carboxylate
CID 60637805

Frequently Asked Questions

What is the IUPAC name of phenyl 2-oxo-3H-indole-1-carboxylate?
The IUPAC name of phenyl 2-oxo-3H-indole-1-carboxylate (CID 15469893) is phenyl 2-oxo-3H-indole-1-carboxylate.
What is the SMILES notation for phenyl 2-oxo-3H-indole-1-carboxylate?
The canonical SMILES for phenyl 2-oxo-3H-indole-1-carboxylate is O=C1Cc2ccccc2N1C(=O)Oc1ccccc1.
What is the InChIKey of phenyl 2-oxo-3H-indole-1-carboxylate?
The InChIKey is ORMJSGNKJURUQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO3/c17-14-10-11-6-4-5-9-13(11)16(14)15(18)19-12-7-2-1-3-8-12/h1-9H,10H2.
What are the key properties of phenyl 2-oxo-3H-indole-1-carboxylate?
phenyl 2-oxo-3H-indole-1-carboxylate has a molecular weight of 253.26 g/mol, XLogP of 2.77, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl 2-oxo-3H-indole-1-carboxylate is sourced from PubChem (CID 15469893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).