N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide

C17H17NO2 — CID 107126922

IUPACN-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide
SMILESO=C(Nc1ccc(O)cc1)C1CCc2ccccc2C1
InChIInChI=1S/C17H17NO2/c19-16-9-7-15(8-10-16)18-17(20)14-6-5-12-3-1-2-4-13(12)11-14/h1-4,7-10,14,19H,5-6,11H2,(H,18,20)
InChIKeyITBMCLGCCSWAFY-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.14
Rot. Bonds2

About N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide

N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide (PubChem CID 107126922) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide
PubChem CID107126922
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC NameN-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide
SMILESO=C(Nc1ccc(O)cc1)C1CCc2ccccc2C1
InChIInChI=1S/C17H17NO2/c19-16-9-7-15(8-10-16)18-17(20)14-6-5-12-3-1-2-4-13(12)11-14/h1-4,7-10,14,19H,5-6,11H2,(H,18,20)
InChIKeyITBMCLGCCSWAFY-UHFFFAOYSA-N
XLogP3.14
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 ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-chloro-4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 107126932
N-(4-bromo-3-chlorophenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 107620504
N-[4-(1H-pyrazol-4-yl)phenyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 58310850
N-phenyl-2,3-dihydro-1H-indene-2-carboxamide
CID 112520410
ethane;N-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 143214414
N-(4-hydroxyphenyl)bicyclo[4.2.0]octa-1,3,5-triene-7-carboxamide
CID 66396911
N-(4-hydroxyphenyl)cycloheptanecarboxamide
CID 62589451
5-bromo-N-(4-hydroxyphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 84578206
N-[(2-hydroxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 107126936
N-(6-fluoro-2-pyridinyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 107127954
N-(2-bromo-3-chlorophenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 107126797
N-(4-hydroxyphenyl)-2-methyl-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide
CID 90640425

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide?
The IUPAC name of N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide (CID 107126922) is N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide?
The canonical SMILES for N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide is O=C(Nc1ccc(O)cc1)C1CCc2ccccc2C1.
What is the InChIKey of N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide?
The InChIKey is ITBMCLGCCSWAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c19-16-9-7-15(8-10-16)18-17(20)14-6-5-12-3-1-2-4-13(12)11-14/h1-4,7-10,14,19H,5-6,11H2,(H,18,20).
What are the key properties of N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide?
N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide has a molecular weight of 267.33 g/mol, XLogP of 3.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-1,2,3,4-tetrahydronaphthalene-2-carboxamide is sourced from PubChem (CID 107126922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).