7-(5-hydroxypentoxy)naphthalen-2-ol

C15H18O3 — CID 62229734

IUPAC7-(5-hydroxypentoxy)naphthalen-2-ol
SMILESOCCCCCOc1ccc2ccc(O)cc2c1
InChIInChI=1S/C15H18O3/c16-8-2-1-3-9-18-15-7-5-12-4-6-14(17)10-13(12)11-15/h4-7,10-11,16-17H,1-3,8-9H2
InChIKeyUFJXLCZSCZUQTL-UHFFFAOYSA-N
MW246.31 g/mol
LogP3.09
Rot. Bonds6

About 7-(5-hydroxypentoxy)naphthalen-2-ol

7-(5-hydroxypentoxy)naphthalen-2-ol (PubChem CID 62229734) has the molecular formula C15H18O3 and a molecular weight of 246.31 g/mol. Its IUPAC name is 7-(5-hydroxypentoxy)naphthalen-2-ol.

Molecular Properties

Compound Name7-(5-hydroxypentoxy)naphthalen-2-ol
PubChem CID62229734
Molecular FormulaC15H18O3
Molecular Weight246.31 g/mol
Exact Mass246.13
IUPAC Name7-(5-hydroxypentoxy)naphthalen-2-ol
SMILESOCCCCCOc1ccc2ccc(O)cc2c1
InChIInChI=1S/C15H18O3/c16-8-2-1-3-9-18-15-7-5-12-4-6-14(17)10-13(12)11-15/h4-7,10-11,16-17H,1-3,8-9H2
InChIKeyUFJXLCZSCZUQTL-UHFFFAOYSA-N
XLogP3.09
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

11-[6-(11-hydroxyundecoxy)naphthalen-2-yl]oxyundecan-1-ol
CID 86182037
11-naphthalen-2-yloxyundecan-1-ol
CID 164916130
3-[7-(3-hydroxypropoxy)naphthalen-2-yl]oxypropan-1-ol
CID 118363614
4-[6-(2-hydroxyethoxy)naphthalen-2-yl]oxybutan-1-ol
CID 138483629
6-chlorohexan-1-ol;6-(6-hydroxyhexoxy)naphthalene-2-carboxylic acid;6-hydroxynaphthalene-2-carboxylic acid;methanol
CID 161289374
4-(6-ethoxynaphthalen-2-yl)oxybutan-1-ol
CID 126699424
8-[6-(4-methylphenyl)naphthalen-2-yl]oxyoctan-1-ol
CID 142809566
7-[2-(trifluoromethylsulfanyl)ethoxy]naphthalen-2-ol
CID 116616550
6-[6-(6-bromonaphthalen-2-yl)oxyhexylsulfonyl]hexan-1-ol
CID 70163219
4-[5-(4-hydroxyphenoxy)pentoxy]phenol
CID 20548963
11-[4-[4-(11-hydroxyundecoxy)phenyl]phenoxy]undecan-1-ol
CID 15113939
7-[(3,5-dimethylphenyl)methoxy]naphthalen-2-ol
CID 63549894

Frequently Asked Questions

What is the IUPAC name of 7-(5-hydroxypentoxy)naphthalen-2-ol?
The IUPAC name of 7-(5-hydroxypentoxy)naphthalen-2-ol (CID 62229734) is 7-(5-hydroxypentoxy)naphthalen-2-ol.
What is the SMILES notation for 7-(5-hydroxypentoxy)naphthalen-2-ol?
The canonical SMILES for 7-(5-hydroxypentoxy)naphthalen-2-ol is OCCCCCOc1ccc2ccc(O)cc2c1.
What is the InChIKey of 7-(5-hydroxypentoxy)naphthalen-2-ol?
The InChIKey is UFJXLCZSCZUQTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O3/c16-8-2-1-3-9-18-15-7-5-12-4-6-14(17)10-13(12)11-15/h4-7,10-11,16-17H,1-3,8-9H2.
What are the key properties of 7-(5-hydroxypentoxy)naphthalen-2-ol?
7-(5-hydroxypentoxy)naphthalen-2-ol has a molecular weight of 246.31 g/mol, XLogP of 3.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(5-hydroxypentoxy)naphthalen-2-ol is sourced from PubChem (CID 62229734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).