1-phenylindole-2-carboxamide

C15H12N2O — CID 6471387

IUPAC1-phenylindole-2-carboxamide
SMILESNC(=O)c1cc2ccccc2n1-c1ccccc1
InChIInChI=1S/C15H12N2O/c16-15(18)14-10-11-6-4-5-9-13(11)17(14)12-7-2-1-3-8-12/h1-10H,(H2,16,18)
InChIKeySHVVLJKMYJRHOL-UHFFFAOYSA-N
MW236.27 g/mol
LogP2.73
Rot. Bonds2

About 1-phenylindole-2-carboxamide

1-phenylindole-2-carboxamide (PubChem CID 6471387) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is 1-phenylindole-2-carboxamide.

Molecular Properties

Compound Name1-phenylindole-2-carboxamide
PubChem CID6471387
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name1-phenylindole-2-carboxamide
SMILESNC(=O)c1cc2ccccc2n1-c1ccccc1
InChIInChI=1S/C15H12N2O/c16-15(18)14-10-11-6-4-5-9-13(11)17(14)12-7-2-1-3-8-12/h1-10H,(H2,16,18)
InChIKeySHVVLJKMYJRHOL-UHFFFAOYSA-N
XLogP2.73
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-phenylindole-2-carboxamide?
The IUPAC name of 1-phenylindole-2-carboxamide (CID 6471387) is 1-phenylindole-2-carboxamide.
What is the SMILES notation for 1-phenylindole-2-carboxamide?
The canonical SMILES for 1-phenylindole-2-carboxamide is NC(=O)c1cc2ccccc2n1-c1ccccc1.
What is the InChIKey of 1-phenylindole-2-carboxamide?
The InChIKey is SHVVLJKMYJRHOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c16-15(18)14-10-11-6-4-5-9-13(11)17(14)12-7-2-1-3-8-12/h1-10H,(H2,16,18).
What are the key properties of 1-phenylindole-2-carboxamide?
1-phenylindole-2-carboxamide has a molecular weight of 236.27 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenylindole-2-carboxamide is sourced from PubChem (CID 6471387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).