3,4-dimethoxythiophen-2-amine

C6H9NO2S — CID 88979037

IUPAC3,4-dimethoxythiophen-2-amine
SMILESCOc1csc(N)c1OC
InChIInChI=1S/C6H9NO2S/c1-8-4-3-10-6(7)5(4)9-2/h3H,7H2,1-2H3
InChIKeyJSMCNMOSHOHCCK-UHFFFAOYSA-N
MW159.21 g/mol
LogP1.35
Rot. Bonds2

About 3,4-dimethoxythiophen-2-amine

3,4-dimethoxythiophen-2-amine (PubChem CID 88979037) has the molecular formula C6H9NO2S and a molecular weight of 159.21 g/mol. Its IUPAC name is 3,4-dimethoxythiophen-2-amine.

Molecular Properties

Compound Name3,4-dimethoxythiophen-2-amine
PubChem CID88979037
Molecular FormulaC6H9NO2S
Molecular Weight159.21 g/mol
Exact Mass159.04
IUPAC Name3,4-dimethoxythiophen-2-amine
SMILESCOc1csc(N)c1OC
InChIInChI=1S/C6H9NO2S/c1-8-4-3-10-6(7)5(4)9-2/h3H,7H2,1-2H3
InChIKeyJSMCNMOSHOHCCK-UHFFFAOYSA-N
XLogP1.35
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.21
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3,4-dimethoxythiophen-2-amine 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-amino-4-methoxythiophene-3-carbonitrile
CID 22902760
methyl 3,4-dimethoxythiophene-2-carboxylate
CID 167832202
2-(3,4-dimethoxythiophen-2-yl)acetic acid
CID 96761580
6-(chloromethyl)-3-methoxy-1-benzothiophen-7-amine
CID 131215542
2,3,5,6-tetramethoxyaniline
CID 19093015
2,3,4-trimethoxyaniline
CID 15455622
3,4,6-trimethoxybenzene-1,2-diamine
CID 14975826
2-amino-4-[2-(2-bromo-3,4,5-trimethoxyphenyl)ethyl]thiophene-3-carbonitrile
CID 10644477
6-fluoro-3-methoxy-1-benzothiophene-7-thiol
CID 130827059
3-methoxy-5-methyl-1-benzothiophen-6-ol
CID 131080839
7-fluoro-3-methoxy-5-methyl-1-benzothiophene
CID 131053876
4-methoxy-2-methylthiophene-3-carboxylic acid
CID 23361773

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxythiophen-2-amine?
The IUPAC name of 3,4-dimethoxythiophen-2-amine (CID 88979037) is 3,4-dimethoxythiophen-2-amine.
What is the SMILES notation for 3,4-dimethoxythiophen-2-amine?
The canonical SMILES for 3,4-dimethoxythiophen-2-amine is COc1csc(N)c1OC.
What is the InChIKey of 3,4-dimethoxythiophen-2-amine?
The InChIKey is JSMCNMOSHOHCCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2S/c1-8-4-3-10-6(7)5(4)9-2/h3H,7H2,1-2H3.
What are the key properties of 3,4-dimethoxythiophen-2-amine?
3,4-dimethoxythiophen-2-amine has a molecular weight of 159.21 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethoxythiophen-2-amine is sourced from PubChem (CID 88979037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).