N-methyl-1-(3-methylthiophen-2-yl)methanamine

C7H11NS — CID 961382

IUPACN-methyl-1-(3-methylthiophen-2-yl)methanamine
SMILESCNCc1sccc1C
InChIInChI=1S/C7H11NS/c1-6-3-4-9-7(6)5-8-2/h3-4,8H,5H2,1-2H3
InChIKeyKSWAIIKUFIWWOC-UHFFFAOYSA-N
MW141.24 g/mol
LogP1.78
Rot. Bonds2

About N-methyl-1-(3-methylthiophen-2-yl)methanamine

N-methyl-1-(3-methylthiophen-2-yl)methanamine (PubChem CID 961382) has the molecular formula C7H11NS and a molecular weight of 141.24 g/mol. Its IUPAC name is N-methyl-1-(3-methylthiophen-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methylthiophen-2-yl)methanamine
PubChem CID961382
Molecular FormulaC7H11NS
Molecular Weight141.24 g/mol
Exact Mass141.06
IUPAC NameN-methyl-1-(3-methylthiophen-2-yl)methanamine
SMILESCNCc1sccc1C
InChIInChI=1S/C7H11NS/c1-6-3-4-9-7(6)5-8-2/h3-4,8H,5H2,1-2H3
InChIKeyKSWAIIKUFIWWOC-UHFFFAOYSA-N
XLogP1.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.24
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-1-(3-methylthiophen-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 N-methyl-1-(3-methylthiophen-2-yl)methanamine?
The IUPAC name of N-methyl-1-(3-methylthiophen-2-yl)methanamine (CID 961382) is N-methyl-1-(3-methylthiophen-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(3-methylthiophen-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(3-methylthiophen-2-yl)methanamine is CNCc1sccc1C.
What is the InChIKey of N-methyl-1-(3-methylthiophen-2-yl)methanamine?
The InChIKey is KSWAIIKUFIWWOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NS/c1-6-3-4-9-7(6)5-8-2/h3-4,8H,5H2,1-2H3.
What are the key properties of N-methyl-1-(3-methylthiophen-2-yl)methanamine?
N-methyl-1-(3-methylthiophen-2-yl)methanamine has a molecular weight of 141.24 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methylthiophen-2-yl)methanamine is sourced from PubChem (CID 961382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).