3-(1-hydroxynaphthalen-2-yl)propanamide

C13H13NO2 — CID 129163797

IUPAC3-(1-hydroxynaphthalen-2-yl)propanamide
SMILESNC(=O)CCc1ccc2ccccc2c1O
InChIInChI=1S/C13H13NO2/c14-12(15)8-7-10-6-5-9-3-1-2-4-11(9)13(10)16/h1-6,16H,7-8H2,(H2,14,15)
InChIKeyYVVNJOSXAUQACR-UHFFFAOYSA-N
MW215.25 g/mol
LogP1.96
Rot. Bonds3

About 3-(1-hydroxynaphthalen-2-yl)propanamide

3-(1-hydroxynaphthalen-2-yl)propanamide (PubChem CID 129163797) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is 3-(1-hydroxynaphthalen-2-yl)propanamide.

Molecular Properties

Compound Name3-(1-hydroxynaphthalen-2-yl)propanamide
PubChem CID129163797
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Name3-(1-hydroxynaphthalen-2-yl)propanamide
SMILESNC(=O)CCc1ccc2ccccc2c1O
InChIInChI=1S/C13H13NO2/c14-12(15)8-7-10-6-5-9-3-1-2-4-11(9)13(10)16/h1-6,16H,7-8H2,(H2,14,15)
InChIKeyYVVNJOSXAUQACR-UHFFFAOYSA-N
XLogP1.96
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-Hydroxy-1-naphthyl)propanamide
CID 44322673
5-(1-Hydroxy-naphthalen-2-yl)-pentanoic acid
CID 23183424
2-Naphthalenecarboxamide, 1-hydroxy-
CID 112837
3-(2-hydroxynaphthalen-1-yl)-N-methylpropanamide
CID 44322541
4-Hydroxynaphthalene-1-carboxamide
CID 18188469
3-(2-Hydroxy-6-(3-hydroxyphenyl)naphthalene-1-yl)-N-methylpropanamide
CID 24949870
2-(4-tert-Butyl-3-hydroxy-2,6-dimethylphenyl)acetamide
CID 20345950
2-(carbamylmethyl)-8-hydroxy-3H-cyclopenta(a)naphthalene
CID 189776
Dichotone A
CID 156581596
2-(3-Hydroxyphenyl)-2-phenylacetamide
CID 6605264
Hydroxy-napthalenacetamide
CID 20349993
3-(1-Hydroxynaphthalen-2-yl)propanoic acid
CID 23183417

Frequently Asked Questions

What is the IUPAC name of 3-(1-hydroxynaphthalen-2-yl)propanamide?
The IUPAC name of 3-(1-hydroxynaphthalen-2-yl)propanamide (CID 129163797) is 3-(1-hydroxynaphthalen-2-yl)propanamide.
What is the SMILES notation for 3-(1-hydroxynaphthalen-2-yl)propanamide?
The canonical SMILES for 3-(1-hydroxynaphthalen-2-yl)propanamide is NC(=O)CCc1ccc2ccccc2c1O.
What is the InChIKey of 3-(1-hydroxynaphthalen-2-yl)propanamide?
The InChIKey is YVVNJOSXAUQACR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c14-12(15)8-7-10-6-5-9-3-1-2-4-11(9)13(10)16/h1-6,16H,7-8H2,(H2,14,15).
What are the key properties of 3-(1-hydroxynaphthalen-2-yl)propanamide?
3-(1-hydroxynaphthalen-2-yl)propanamide has a molecular weight of 215.25 g/mol, XLogP of 1.96, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-hydroxynaphthalen-2-yl)propanamide is sourced from PubChem (CID 129163797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).