5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide

C17H16N2O2 — CID 15211855

IUPAC5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide
SMILESCN(C(=O)c1cc2cc(O)ccc2n1C)c1ccccc1
InChIInChI=1S/C17H16N2O2/c1-18(13-6-4-3-5-7-13)17(21)16-11-12-10-14(20)8-9-15(12)19(16)2/h3-11,20H,1-2H3
InChIKeyOURSOMLIIYDTJB-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.16
Rot. Bonds2

About 5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide

5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide (PubChem CID 15211855) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide
PubChem CID15211855
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide
SMILESCN(C(=O)c1cc2cc(O)ccc2n1C)c1ccccc1
InChIInChI=1S/C17H16N2O2/c1-18(13-6-4-3-5-7-13)17(21)16-11-12-10-14(20)8-9-15(12)19(16)2/h3-11,20H,1-2H3
InChIKeyOURSOMLIIYDTJB-UHFFFAOYSA-N
XLogP3.16
TPSA45.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide?
The IUPAC name of 5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide (CID 15211855) is 5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide.
What is the SMILES notation for 5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide?
The canonical SMILES for 5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide is CN(C(=O)c1cc2cc(O)ccc2n1C)c1ccccc1.
What is the InChIKey of 5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide?
The InChIKey is OURSOMLIIYDTJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-18(13-6-4-3-5-7-13)17(21)16-11-12-10-14(20)8-9-15(12)19(16)2/h3-11,20H,1-2H3.
What are the key properties of 5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide?
5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N,1-dimethyl-N-phenylindole-2-carboxamide is sourced from PubChem (CID 15211855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).