3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide

C14H15NO3 — CID 43312351

IUPAC3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide
SMILESCC(COc1ccc2ccc(O)cc2c1)C(N)=O
InChIInChI=1S/C14H15NO3/c1-9(14(15)17)8-18-13-5-3-10-2-4-12(16)6-11(10)7-13/h2-7,9,16H,8H2,1H3,(H2,15,17)
InChIKeyNBIRHWIBJPEPSS-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.05
Rot. Bonds4

About 3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide

3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide (PubChem CID 43312351) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is 3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide.

Molecular Properties

Compound Name3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide
PubChem CID43312351
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide
SMILESCC(COc1ccc2ccc(O)cc2c1)C(N)=O
InChIInChI=1S/C14H15NO3/c1-9(14(15)17)8-18-13-5-3-10-2-4-12(16)6-11(10)7-13/h2-7,9,16H,8H2,1H3,(H2,15,17)
InChIKeyNBIRHWIBJPEPSS-UHFFFAOYSA-N
XLogP2.05
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-5-naphthalen-2-yloxypentanamide
CID 142457986
3-[4-[(1R)-1-hydroxyethyl]phenoxy]-2-methylpropanamide
CID 63364284
7-butan-2-yloxynaphthalen-2-ol
CID 43143670
3-[4-(aminomethyl)phenoxy]-2-methylpropanamide
CID 43311802
3-(3-iodophenoxy)-2-methylpropanamide
CID 61400057
4-(3-amino-2-methyl-3-oxopropoxy)-2-fluorobenzoic acid
CID 107675315
(2R)-3-(4-cyanophenoxy)-2-methylpropanamide
CID 70943065
3-(4-butan-2-ylphenoxy)-2-methylpropanamide
CID 107669112
7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol
CID 63549894
2-(7-hydroxynaphthalen-2-yl)oxy-N,N-dimethylpropanamide
CID 43143635
3-[3-fluoro-4-[1-(methylamino)ethyl]phenoxy]-2-methylpropanamide
CID 107716852
N,N-diethyl-2-(7-hydroxynaphthalen-2-yl)oxypropanamide
CID 43143630

Frequently Asked Questions

What is the IUPAC name of 3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide?
The IUPAC name of 3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide (CID 43312351) is 3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide.
What is the SMILES notation for 3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide?
The canonical SMILES for 3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide is CC(COc1ccc2ccc(O)cc2c1)C(N)=O.
What is the InChIKey of 3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide?
The InChIKey is NBIRHWIBJPEPSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-9(14(15)17)8-18-13-5-3-10-2-4-12(16)6-11(10)7-13/h2-7,9,16H,8H2,1H3,(H2,15,17).
What are the key properties of 3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide?
3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide has a molecular weight of 245.28 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-hydroxynaphthalen-2-yl)oxy-2-methylpropanamide is sourced from PubChem (CID 43312351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).