N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide

C17H19NO2 — CID 115769307

IUPACN-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide
SMILESCC(NC(=O)c1cc2ccccc2cc1O)C1CCC1
InChIInChI=1S/C17H19NO2/c1-11(12-7-4-8-12)18-17(20)15-9-13-5-2-3-6-14(13)10-16(15)19/h2-3,5-6,9-12,19H,4,7-8H2,1H3,(H,18,20)
InChIKeyMSMUTZCJIRJOHE-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.46
Rot. Bonds3

About N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide

N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide (PubChem CID 115769307) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide
PubChem CID115769307
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC NameN-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide
SMILESCC(NC(=O)c1cc2ccccc2cc1O)C1CCC1
InChIInChI=1S/C17H19NO2/c1-11(12-7-4-8-12)18-17(20)15-9-13-5-2-3-6-14(13)10-16(15)19/h2-3,5-6,9-12,19H,4,7-8H2,1H3,(H,18,20)
InChIKeyMSMUTZCJIRJOHE-UHFFFAOYSA-N
XLogP3.46
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclopentylethyl)-3-hydroxy-2-methylbenzamide
CID 82828967
N-(2-cyclopropylpropyl)-3-hydroxynaphthalene-2-carboxamide
CID 115591184
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CID 115769042
2-hydroxy-N-(1-piperidin-4-ylethyl)benzamide
CID 43523239
5-chloro-N-(1-cyclopropylethyl)-2-hydroxybenzamide
CID 43401499
N-[(1R)-1-cyclohexylethyl]-2-(propan-2-ylamino)benzamide
CID 81389065
2,4-dibromo-N-(1-cyclobutylethyl)benzamide
CID 103883323
2-(1-cyclopropylethylcarbamoyl)benzoic acid
CID 43533392
2-bromo-N-(1-cyclobutylethyl)-3-methylbenzamide
CID 103855542
N-(1-cyclohexylethyl)-2-(2-hydroxyphenyl)acetamide
CID 79039260
4-bromo-N-(1-cyclohexylethyl)-3-hydroxybenzamide
CID 103873468
N-(1-piperidin-4-ylethyl)naphthalene-2-carboxamide
CID 43523229

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide?
The IUPAC name of N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide (CID 115769307) is N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide?
The canonical SMILES for N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide is CC(NC(=O)c1cc2ccccc2cc1O)C1CCC1.
What is the InChIKey of N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide?
The InChIKey is MSMUTZCJIRJOHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-11(12-7-4-8-12)18-17(20)15-9-13-5-2-3-6-14(13)10-16(15)19/h2-3,5-6,9-12,19H,4,7-8H2,1H3,(H,18,20).
What are the key properties of N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide?
N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide has a molecular weight of 269.34 g/mol, XLogP of 3.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclobutylethyl)-3-hydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 115769307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).