[4-(phenylmethoxymethyl)naphthalen-1-yl]methanol

C19H18O2 — CID 146459770

IUPAC[4-(phenylmethoxymethyl)naphthalen-1-yl]methanol
SMILESOCc1ccc(COCc2ccccc2)c2ccccc12
InChIInChI=1S/C19H18O2/c20-12-16-10-11-17(19-9-5-4-8-18(16)19)14-21-13-15-6-2-1-3-7-15/h1-11,20H,12-14H2
InChIKeyCPZPELHNHCIIQF-UHFFFAOYSA-N
MW278.35 g/mol
LogP4.05
Rot. Bonds5

About [4-(phenylmethoxymethyl)naphthalen-1-yl]methanol

[4-(phenylmethoxymethyl)naphthalen-1-yl]methanol (PubChem CID 146459770) has the molecular formula C19H18O2 and a molecular weight of 278.35 g/mol. Its IUPAC name is [4-(phenylmethoxymethyl)naphthalen-1-yl]methanol.

Molecular Properties

Compound Name[4-(phenylmethoxymethyl)naphthalen-1-yl]methanol
PubChem CID146459770
Molecular FormulaC19H18O2
Molecular Weight278.35 g/mol
Exact Mass278.13
IUPAC Name[4-(phenylmethoxymethyl)naphthalen-1-yl]methanol
SMILESOCc1ccc(COCc2ccccc2)c2ccccc12
InChIInChI=1S/C19H18O2/c20-12-16-10-11-17(19-9-5-4-8-18(16)19)14-21-13-15-6-2-1-3-7-15/h1-11,20H,12-14H2
InChIKeyCPZPELHNHCIIQF-UHFFFAOYSA-N
XLogP4.05
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(phenylmethoxymethyl)phenyl]methanol
CID 54193166
CID 66734377
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3-[[4-(2,3-dihydroxypropoxymethyl)naphthalen-1-yl]methoxy]propane-1,2-diol
CID 15536755
dimethyltin;phenylmethoxymethylbenzene
CID 87392963
N-methylmethanamine;phenylmethoxymethylbenzene
CID 70181699
2-(2-methylphenyl)-N-[[4-(phenylmethoxymethyl)phenyl]methyl]acetamide
CID 46464858

Frequently Asked Questions

What is the IUPAC name of [4-(phenylmethoxymethyl)naphthalen-1-yl]methanol?
The IUPAC name of [4-(phenylmethoxymethyl)naphthalen-1-yl]methanol (CID 146459770) is [4-(phenylmethoxymethyl)naphthalen-1-yl]methanol.
What is the SMILES notation for [4-(phenylmethoxymethyl)naphthalen-1-yl]methanol?
The canonical SMILES for [4-(phenylmethoxymethyl)naphthalen-1-yl]methanol is OCc1ccc(COCc2ccccc2)c2ccccc12.
What is the InChIKey of [4-(phenylmethoxymethyl)naphthalen-1-yl]methanol?
The InChIKey is CPZPELHNHCIIQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18O2/c20-12-16-10-11-17(19-9-5-4-8-18(16)19)14-21-13-15-6-2-1-3-7-15/h1-11,20H,12-14H2.
What are the key properties of [4-(phenylmethoxymethyl)naphthalen-1-yl]methanol?
[4-(phenylmethoxymethyl)naphthalen-1-yl]methanol has a molecular weight of 278.35 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(phenylmethoxymethyl)naphthalen-1-yl]methanol is sourced from PubChem (CID 146459770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).