N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide

C17H17NO2 — CID 106703052

IUPACN-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
SMILESCc1ccc(NC(=O)C2Cc3ccccc3C2)c(O)c1
InChIInChI=1S/C17H17NO2/c1-11-6-7-15(16(19)8-11)18-17(20)14-9-12-4-2-3-5-13(12)10-14/h2-8,14,19H,9-10H2,1H3,(H,18,20)
InChIKeyDCUINAZBPZPRJF-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.05
Rot. Bonds2

About N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide

N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 106703052) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID106703052
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC NameN-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
SMILESCc1ccc(NC(=O)C2Cc3ccccc3C2)c(O)c1
InChIInChI=1S/C17H17NO2/c1-11-6-7-15(16(19)8-11)18-17(20)14-9-12-4-2-3-5-13(12)10-14/h2-8,14,19H,9-10H2,1H3,(H,18,20)
InChIKeyDCUINAZBPZPRJF-UHFFFAOYSA-N
XLogP3.05
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(2,4-dimethylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 112522893
N-(2-bromo-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106737103
N-(2,5-dimethylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 112520843
(2-hydroxy-4-methylphenyl)carbamic acid
CID 150954489
N-(2-acetylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106703126
N-(2-hydroxy-4-methylphenyl)adamantane-2-carboxamide
CID 78915665
N-(4-bromo-2-ethylphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106703922
2-[(2-hydroxy-4-methylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 22688939
N-phenyl-2,3-dihydro-1H-indene-2-carboxamide
CID 112520410
methyl N-(2-hydroxy-4-methylphenyl)carbamate
CID 61269197
N-(2,5-dimethoxyphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 112520928
N-(2,4-dimethylphenyl)cyclopropanecarboxamide
CID 5066654

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide (CID 106703052) is N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide is Cc1ccc(NC(=O)C2Cc3ccccc3C2)c(O)c1.
What is the InChIKey of N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is DCUINAZBPZPRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c1-11-6-7-15(16(19)8-11)18-17(20)14-9-12-4-2-3-5-13(12)10-14/h2-8,14,19H,9-10H2,1H3,(H,18,20).
What are the key properties of N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide?
N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 267.33 g/mol, XLogP of 3.05, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-4-methylphenyl)-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 106703052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).