1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine

C11H15N3OS — CID 81124503

IUPAC1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine
SMILESCNC(c1sccc1OC)c1nccn1C
InChIInChI=1S/C11H15N3OS/c1-12-9(11-13-5-6-14(11)2)10-8(15-3)4-7-16-10/h4-7,9,12H,1-3H3
InChIKeyIEZBXYMMDDCDTN-UHFFFAOYSA-N
MW237.33 g/mol
LogP1.80
Rot. Bonds4

About 1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine

1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine (PubChem CID 81124503) has the molecular formula C11H15N3OS and a molecular weight of 237.33 g/mol. Its IUPAC name is 1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine.

Molecular Properties

Compound Name1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine
PubChem CID81124503
Molecular FormulaC11H15N3OS
Molecular Weight237.33 g/mol
Exact Mass237.09
IUPAC Name1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine
SMILESCNC(c1sccc1OC)c1nccn1C
InChIInChI=1S/C11H15N3OS/c1-12-9(11-13-5-6-14(11)2)10-8(15-3)4-7-16-10/h4-7,9,12H,1-3H3
InChIKeyIEZBXYMMDDCDTN-UHFFFAOYSA-N
XLogP1.80
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine 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 1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine?
The IUPAC name of 1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine (CID 81124503) is 1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine.
What is the SMILES notation for 1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine?
The canonical SMILES for 1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine is CNC(c1sccc1OC)c1nccn1C.
What is the InChIKey of 1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine?
The InChIKey is IEZBXYMMDDCDTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3OS/c1-12-9(11-13-5-6-14(11)2)10-8(15-3)4-7-16-10/h4-7,9,12H,1-3H3.
What are the key properties of 1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine?
1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine has a molecular weight of 237.33 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxythiophen-2-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine is sourced from PubChem (CID 81124503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).