4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide

C18H15NO2 — CID 53324529

IUPAC4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide
SMILESCNC(=O)c1ccc(-c2ccc3c(O)cccc3c2)cc1
InChIInChI=1S/C18H15NO2/c1-19-18(21)13-7-5-12(6-8-13)14-9-10-16-15(11-14)3-2-4-17(16)20/h2-11,20H,1H3,(H,19,21)
InChIKeyBYBCSGOQYNZNRC-UHFFFAOYSA-N
MW277.32 g/mol
LogP3.57
Rot. Bonds2

About 4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide

4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide (PubChem CID 53324529) has the molecular formula C18H15NO2 and a molecular weight of 277.32 g/mol. Its IUPAC name is 4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide.

Molecular Properties

Compound Name4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide
PubChem CID53324529
Molecular FormulaC18H15NO2
Molecular Weight277.32 g/mol
Exact Mass277.11
IUPAC Name4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide
SMILESCNC(=O)c1ccc(-c2ccc3c(O)cccc3c2)cc1
InChIInChI=1S/C18H15NO2/c1-19-18(21)13-7-5-12(6-8-13)14-9-10-16-15(11-14)3-2-4-17(16)20/h2-11,20H,1H3,(H,19,21)
InChIKeyBYBCSGOQYNZNRC-UHFFFAOYSA-N
XLogP3.57
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-(4-hydroxyphenyl)naphthalen-1-ol
CID 10308021
6-pyridin-4-ylnaphthalen-1-ol
CID 53321857
6-[4-(2-hydroxyphenyl)phenyl]naphthalen-1-ol
CID 138695753
5-hydroxy-N-propylnaphthalene-2-carboxamide
CID 172677586
4-(4-aminophenyl)-N-methylbenzamide
CID 91665695
4-tert-butyl-N-[(5-hydroxynaphthalen-2-yl)carbamothioyl]benzamide
CID 142713593
6-(4-hydroxy-3-methoxyphenyl)naphthalen-1-ol
CID 56648216
6-(3,4-dimethoxyphenyl)naphthalen-1-ol
CID 56648124
5-hydroxy-N-methyl-7-nitronaphthalene-2-carboxamide
CID 163232985
3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide
CID 24950040
methylcarbamic acid;naphthalen-1-ol
CID 53442833
N-cyclobutyl-5-hydroxynaphthalene-2-carboxamide
CID 172677591

Frequently Asked Questions

What is the IUPAC name of 4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide?
The IUPAC name of 4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide (CID 53324529) is 4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide.
What is the SMILES notation for 4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide?
The canonical SMILES for 4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide is CNC(=O)c1ccc(-c2ccc3c(O)cccc3c2)cc1.
What is the InChIKey of 4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide?
The InChIKey is BYBCSGOQYNZNRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO2/c1-19-18(21)13-7-5-12(6-8-13)14-9-10-16-15(11-14)3-2-4-17(16)20/h2-11,20H,1H3,(H,19,21).
What are the key properties of 4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide?
4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide has a molecular weight of 277.32 g/mol, XLogP of 3.57, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-hydroxynaphthalen-2-yl)-N-methylbenzamide is sourced from PubChem (CID 53324529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).