6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide

C20H19N3O2 — CID 69045021

IUPAC6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide
SMILESCC1(C(=O)Nc2ncc[nH]2)Cc2ccc(O)cc2C1c1ccccc1
InChIInChI=1S/C20H19N3O2/c1-20(18(25)23-19-21-9-10-22-19)12-14-7-8-15(24)11-16(14)17(20)13-5-3-2-4-6-13/h2-11,17,24H,12H2,1H3,(H2,21,22,23,25)
InChIKeyXBNPPHOHFQVGIJ-UHFFFAOYSA-N
MW333.39 g/mol
LogP3.45
Rot. Bonds3

About 6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide

6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide (PubChem CID 69045021) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is 6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide.

Molecular Properties

Compound Name6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide
PubChem CID69045021
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC Name6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide
SMILESCC1(C(=O)Nc2ncc[nH]2)Cc2ccc(O)cc2C1c1ccccc1
InChIInChI=1S/C20H19N3O2/c1-20(18(25)23-19-21-9-10-22-19)12-14-7-8-15(24)11-16(14)17(20)13-5-3-2-4-6-13/h2-11,17,24H,12H2,1H3,(H2,21,22,23,25)
InChIKeyXBNPPHOHFQVGIJ-UHFFFAOYSA-N
XLogP3.45
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 53.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide?
The IUPAC name of 6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide (CID 69045021) is 6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide.
What is the SMILES notation for 6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide?
The canonical SMILES for 6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide is CC1(C(=O)Nc2ncc[nH]2)Cc2ccc(O)cc2C1c1ccccc1.
What is the InChIKey of 6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide?
The InChIKey is XBNPPHOHFQVGIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-20(18(25)23-19-21-9-10-22-19)12-14-7-8-15(24)11-16(14)17(20)13-5-3-2-4-6-13/h2-11,17,24H,12H2,1H3,(H2,21,22,23,25).
What are the key properties of 6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide?
6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 3.45, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-N-(1H-imidazol-2-yl)-2-methyl-1-phenyl-1,3-dihydroindene-2-carboxamide is sourced from PubChem (CID 69045021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).