N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide

C17H17NO2 — CID 106703935

IUPACN-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESO=C(NCc1ccccc1O)C1Cc2ccccc2C1
InChIInChI=1S/C17H17NO2/c19-16-8-4-3-7-14(16)11-18-17(20)15-9-12-5-1-2-6-13(12)10-15/h1-8,15,19H,9-11H2,(H,18,20)
InChIKeyCRGHIRVZEVHFTJ-UHFFFAOYSA-N
MW267.33 g/mol
LogP2.42
Rot. Bonds3

About N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide

N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 106703935) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID106703935
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC NameN-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide
SMILESO=C(NCc1ccccc1O)C1Cc2ccccc2C1
InChIInChI=1S/C17H17NO2/c19-16-8-4-3-7-14(16)11-18-17(20)15-9-12-5-1-2-6-13(12)10-15/h1-8,15,19H,9-11H2,(H,18,20)
InChIKeyCRGHIRVZEVHFTJ-UHFFFAOYSA-N
XLogP2.42
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

N-[(2-hydroxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 107126936
N-[[4-[(2,3-dihydro-1H-indene-2-carbonylamino)methyl]phenyl]methyl]-2,3-dihydro-1H-indene-2-carboxamide
CID 155137344
N-[(2-hydroxyphenyl)methyl]cyclopentanecarboxamide
CID 110470991
3-[(2-hydroxyphenyl)methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 103551256
N-[[3-(aminomethyl)phenyl]methyl]-2,3-dihydro-1H-indene-2-carboxamide
CID 106892179
(3R)-N-[(2-fluorophenyl)methyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 51546919
N-[[2-(hydroxymethyl)phenyl]methyl]cyclopropanecarboxamide
CID 110902492
N-[(2-chlorophenyl)methyl]cyclopropanecarboxamide
CID 899098
N-[2-(hydroxymethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide
CID 106893200
N-(3,3,3-trifluoropropyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 112527808
N-[2-(methylaminomethyl)phenyl]-2,3-dihydro-1H-indene-2-carboxamide
CID 106893270
(3R)-N-[(2-chlorophenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 28514089

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide (CID 106703935) is N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide is O=C(NCc1ccccc1O)C1Cc2ccccc2C1.
What is the InChIKey of N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is CRGHIRVZEVHFTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c19-16-8-4-3-7-14(16)11-18-17(20)15-9-12-5-1-2-6-13(12)10-15/h1-8,15,19H,9-11H2,(H,18,20).
What are the key properties of N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide?
N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 267.33 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxyphenyl)methyl]-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 106703935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).