1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol

C15H18O3 — CID 43504354

IUPAC1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol
SMILESCOCCOc1c(C(C)O)ccc2ccccc12
InChIInChI=1S/C15H18O3/c1-11(16)13-8-7-12-5-3-4-6-14(12)15(13)18-10-9-17-2/h3-8,11,16H,9-10H2,1-2H3
InChIKeyNWDMGZZKCDOPSA-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.92
Rot. Bonds5

About 1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol

1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol (PubChem CID 43504354) has the molecular formula C15H18O3 and a molecular weight of 246.31 g/mol. Its IUPAC name is 1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol.

Molecular Properties

Compound Name1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol
PubChem CID43504354
Molecular FormulaC15H18O3
Molecular Weight246.31 g/mol
Exact Mass246.13
IUPAC Name1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol
SMILESCOCCOc1c(C(C)O)ccc2ccccc12
InChIInChI=1S/C15H18O3/c1-11(16)13-8-7-12-5-3-4-6-14(12)15(13)18-10-9-17-2/h3-8,11,16H,9-10H2,1-2H3
InChIKeyNWDMGZZKCDOPSA-UHFFFAOYSA-N
XLogP2.92
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(1R)-1-[1-(2-fluoroethoxy)naphthalen-2-yl]ethanol
CID 80694280
(1R)-1-[1-[2-(trifluoromethoxy)ethoxy]naphthalen-2-yl]ethanol
CID 79014754
(1S)-1-(1-hexoxynaphthalen-2-yl)ethanol
CID 78944606
3-[2-[(1S)-1-hydroxyethyl]naphthalen-1-yl]oxy-N,N-dimethylpropanamide
CID 63365385
(1R)-1-[1-[2-(diethylamino)ethoxy]naphthalen-2-yl]ethanol
CID 78933650
N-[1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethyl]propan-1-amine
CID 43475279
(1S)-1-(1-hept-6-enoxynaphthalen-2-yl)ethanol
CID 107007499
(1S)-1-[1-(pyrimidin-2-ylmethoxy)naphthalen-2-yl]ethanol
CID 63365341
(1R)-1-[1-(2-methylbutoxy)naphthalen-2-yl]ethanol
CID 63365584
1-(1-propan-2-yloxynaphthalen-2-yl)ethanol
CID 43504390
2-[2-(1-hydroxyethyl)naphthalen-1-yl]oxy-N-propan-2-ylacetamide
CID 43504387
(1R)-1-[1-[(E)-3-chloro-2-methylprop-2-enoxy]naphthalen-2-yl]ethanol
CID 106438840

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol?
The IUPAC name of 1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol (CID 43504354) is 1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol.
What is the SMILES notation for 1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol?
The canonical SMILES for 1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol is COCCOc1c(C(C)O)ccc2ccccc12.
What is the InChIKey of 1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol?
The InChIKey is NWDMGZZKCDOPSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O3/c1-11(16)13-8-7-12-5-3-4-6-14(12)15(13)18-10-9-17-2/h3-8,11,16H,9-10H2,1-2H3.
What are the key properties of 1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol?
1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol has a molecular weight of 246.31 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methoxyethoxy)naphthalen-2-yl]ethanol is sourced from PubChem (CID 43504354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).