5-methoxy-1-methylpyrrol-2-amine

C6H10N2O — CID 69341825

IUPAC5-methoxy-1-methylpyrrol-2-amine
SMILESCOc1ccc(N)n1C
InChIInChI=1S/C6H10N2O/c1-8-5(7)3-4-6(8)9-2/h3-4H,7H2,1-2H3
InChIKeyYDSBOOISKHFZHW-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.62
Rot. Bonds1

About 5-methoxy-1-methylpyrrol-2-amine

5-methoxy-1-methylpyrrol-2-amine (PubChem CID 69341825) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is 5-methoxy-1-methylpyrrol-2-amine.

Molecular Properties

Compound Name5-methoxy-1-methylpyrrol-2-amine
PubChem CID69341825
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name5-methoxy-1-methylpyrrol-2-amine
SMILESCOc1ccc(N)n1C
InChIInChI=1S/C6H10N2O/c1-8-5(7)3-4-6(8)9-2/h3-4H,7H2,1-2H3
InChIKeyYDSBOOISKHFZHW-UHFFFAOYSA-N
XLogP0.62
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-methoxy-1-methylpyrrol-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

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-methylpyrrol-2-amine?
The IUPAC name of 5-methoxy-1-methylpyrrol-2-amine (CID 69341825) is 5-methoxy-1-methylpyrrol-2-amine.
What is the SMILES notation for 5-methoxy-1-methylpyrrol-2-amine?
The canonical SMILES for 5-methoxy-1-methylpyrrol-2-amine is COc1ccc(N)n1C.
What is the InChIKey of 5-methoxy-1-methylpyrrol-2-amine?
The InChIKey is YDSBOOISKHFZHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-8-5(7)3-4-6(8)9-2/h3-4H,7H2,1-2H3.
What are the key properties of 5-methoxy-1-methylpyrrol-2-amine?
5-methoxy-1-methylpyrrol-2-amine has a molecular weight of 126.16 g/mol, XLogP of 0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-methylpyrrol-2-amine is sourced from PubChem (CID 69341825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).