2-bromo-5-(naphthalen-2-yloxymethyl)thiophene

C15H11BrOS — CID 63458037

IUPAC2-bromo-5-(naphthalen-2-yloxymethyl)thiophene
SMILESBrc1ccc(COc2ccc3ccccc3c2)s1
InChIInChI=1S/C15H11BrOS/c16-15-8-7-14(18-15)10-17-13-6-5-11-3-1-2-4-12(11)9-13/h1-9H,10H2
InChIKeyJMMJYYOFJXRPID-UHFFFAOYSA-N
MW319.22 g/mol
LogP5.24
Rot. Bonds3

About 2-bromo-5-(naphthalen-2-yloxymethyl)thiophene

2-bromo-5-(naphthalen-2-yloxymethyl)thiophene (PubChem CID 63458037) has the molecular formula C15H11BrOS and a molecular weight of 319.22 g/mol. Its IUPAC name is 2-bromo-5-(naphthalen-2-yloxymethyl)thiophene.

Molecular Properties

Compound Name2-bromo-5-(naphthalen-2-yloxymethyl)thiophene
PubChem CID63458037
Molecular FormulaC15H11BrOS
Molecular Weight319.22 g/mol
Exact Mass317.97
IUPAC Name2-bromo-5-(naphthalen-2-yloxymethyl)thiophene
SMILESBrc1ccc(COc2ccc3ccccc3c2)s1
InChIInChI=1S/C15H11BrOS/c16-15-8-7-14(18-15)10-17-13-6-5-11-3-1-2-4-12(11)9-13/h1-9H,10H2
InChIKeyJMMJYYOFJXRPID-UHFFFAOYSA-N
XLogP5.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.22
LogP ≤ 55.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-bromo-5-(naphthalen-2-yloxymethyl)thiophene 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-[3-[(5-bromothiophen-2-yl)methoxy]phenyl]ethanamine
CID 54930992
5-[(5-bromothiophen-2-yl)methoxy]-2-fluoropyridine
CID 115371625
2-chloro-5-(naphthalen-2-yloxymethyl)-1,3,4-thiadiazole
CID 80609998
2-(bromomethyl)-5-[(5-bromothiophen-2-yl)methoxy]pyridine
CID 79800755
8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline
CID 63457720
(1R)-1-[4-[(5-bromothiophen-2-yl)methoxy]phenyl]propan-1-amine
CID 78937135
2-bromo-5-[(2-phenylphenoxy)methyl]thiophene
CID 63458852
[2-[(5-bromothiophen-2-yl)methoxy]phenyl]methanol
CID 28562651
N-[[3-[(5-bromothiophen-2-yl)methoxy]phenyl]methyl]-2-methylpropan-1-amine
CID 63486876
5-[(5-bromothiophen-2-yl)methoxy]pyridine-2-carboxylic acid
CID 79794866
3-[5-[(5-bromothiophen-2-yl)methoxy]-2-pyridinyl]prop-2-enoic acid
CID 79799402
2-ethoxynaphthalene
CID 118978197

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-(naphthalen-2-yloxymethyl)thiophene?
The IUPAC name of 2-bromo-5-(naphthalen-2-yloxymethyl)thiophene (CID 63458037) is 2-bromo-5-(naphthalen-2-yloxymethyl)thiophene.
What is the SMILES notation for 2-bromo-5-(naphthalen-2-yloxymethyl)thiophene?
The canonical SMILES for 2-bromo-5-(naphthalen-2-yloxymethyl)thiophene is Brc1ccc(COc2ccc3ccccc3c2)s1.
What is the InChIKey of 2-bromo-5-(naphthalen-2-yloxymethyl)thiophene?
The InChIKey is JMMJYYOFJXRPID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrOS/c16-15-8-7-14(18-15)10-17-13-6-5-11-3-1-2-4-12(11)9-13/h1-9H,10H2.
What are the key properties of 2-bromo-5-(naphthalen-2-yloxymethyl)thiophene?
2-bromo-5-(naphthalen-2-yloxymethyl)thiophene has a molecular weight of 319.22 g/mol, XLogP of 5.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-(naphthalen-2-yloxymethyl)thiophene is sourced from PubChem (CID 63458037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).