(4-bromo-2-naphthalen-1-yloxyphenyl)methanol

C17H13BrO2 — CID 43174100

IUPAC(4-bromo-2-naphthalen-1-yloxyphenyl)methanol
SMILESOCc1ccc(Br)cc1Oc1cccc2ccccc12
InChIInChI=1S/C17H13BrO2/c18-14-9-8-13(11-19)17(10-14)20-16-7-3-5-12-4-1-2-6-15(12)16/h1-10,19H,11H2
InChIKeySOQOKDOPOUZFAT-UHFFFAOYSA-N
MW329.19 g/mol
LogP4.89
Rot. Bonds3

About (4-bromo-2-naphthalen-1-yloxyphenyl)methanol

(4-bromo-2-naphthalen-1-yloxyphenyl)methanol (PubChem CID 43174100) has the molecular formula C17H13BrO2 and a molecular weight of 329.19 g/mol. Its IUPAC name is (4-bromo-2-naphthalen-1-yloxyphenyl)methanol.

Molecular Properties

Compound Name(4-bromo-2-naphthalen-1-yloxyphenyl)methanol
PubChem CID43174100
Molecular FormulaC17H13BrO2
Molecular Weight329.19 g/mol
Exact Mass328.01
IUPAC Name(4-bromo-2-naphthalen-1-yloxyphenyl)methanol
SMILESOCc1ccc(Br)cc1Oc1cccc2ccccc12
InChIInChI=1S/C17H13BrO2/c18-14-9-8-13(11-19)17(10-14)20-16-7-3-5-12-4-1-2-6-15(12)16/h1-10,19H,11H2
InChIKeySOQOKDOPOUZFAT-UHFFFAOYSA-N
XLogP4.89
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.19
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-bromo-2-naphthalen-1-yloxyphenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[2-(aminomethyl)-5-bromophenoxy]phenyl]methanol
CID 63654318
(5-bromo-2-naphthalen-1-yloxyphenyl)methanamine
CID 114889861
[4-bromo-2-(2-nitrophenoxy)phenyl]methanol
CID 54915296
[2-(1-bromonaphthalen-2-yl)oxy-4-chlorophenyl]methanol
CID 114846123
[4-bromo-2-(4-tert-butyl-2-methylphenoxy)phenyl]methanol
CID 43365121
[2-(5-bromo-2,3-difluorophenoxy)phenyl]methanol
CID 107100181
4-bromo-1-(chloromethyl)-2-(2-ethylphenoxy)benzene
CID 43365212
1-[4-(hydroxymethyl)-3-(sulfinoamino)phenoxy]naphthalene
CID 59962160
[4-bromo-2-(3-bromo-4-fluorophenoxy)phenyl]methanol
CID 83234633
[5-bromo-2-(2,3-dichlorophenoxy)phenyl]methanol
CID 114061460
4-naphthalen-1-yloxynaphthalen-1-ol
CID 69008300
1-(2-ethylphenoxy)naphthalene
CID 154158015

Frequently Asked Questions

What is the IUPAC name of (4-bromo-2-naphthalen-1-yloxyphenyl)methanol?
The IUPAC name of (4-bromo-2-naphthalen-1-yloxyphenyl)methanol (CID 43174100) is (4-bromo-2-naphthalen-1-yloxyphenyl)methanol.
What is the SMILES notation for (4-bromo-2-naphthalen-1-yloxyphenyl)methanol?
The canonical SMILES for (4-bromo-2-naphthalen-1-yloxyphenyl)methanol is OCc1ccc(Br)cc1Oc1cccc2ccccc12.
What is the InChIKey of (4-bromo-2-naphthalen-1-yloxyphenyl)methanol?
The InChIKey is SOQOKDOPOUZFAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13BrO2/c18-14-9-8-13(11-19)17(10-14)20-16-7-3-5-12-4-1-2-6-15(12)16/h1-10,19H,11H2.
What are the key properties of (4-bromo-2-naphthalen-1-yloxyphenyl)methanol?
(4-bromo-2-naphthalen-1-yloxyphenyl)methanol has a molecular weight of 329.19 g/mol, XLogP of 4.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-2-naphthalen-1-yloxyphenyl)methanol is sourced from PubChem (CID 43174100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).