1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine

C6H11NS — CID 89258846

IUPAC1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine
SMILESCNCC1CC=CS1
InChIInChI=1S/C6H11NS/c1-7-5-6-3-2-4-8-6/h2,4,6-7H,3,5H2,1H3
InChIKeySCDLXQMIFCREMW-UHFFFAOYSA-N
MW129.23 g/mol
LogP1.23
Rot. Bonds2

About 1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine

1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine (PubChem CID 89258846) has the molecular formula C6H11NS and a molecular weight of 129.23 g/mol. Its IUPAC name is 1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine
PubChem CID89258846
Molecular FormulaC6H11NS
Molecular Weight129.23 g/mol
Exact Mass129.06
IUPAC Name1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine
SMILESCNCC1CC=CS1
InChIInChI=1S/C6H11NS/c1-7-5-6-3-2-4-8-6/h2,4,6-7H,3,5H2,1H3
InChIKeySCDLXQMIFCREMW-UHFFFAOYSA-N
XLogP1.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.23
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine (CID 89258846) is 1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine is CNCC1CC=CS1.
What is the InChIKey of 1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine?
The InChIKey is SCDLXQMIFCREMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NS/c1-7-5-6-3-2-4-8-6/h2,4,6-7H,3,5H2,1H3.
What are the key properties of 1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine?
1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine has a molecular weight of 129.23 g/mol, XLogP of 1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrothiophen-2-yl)-N-methylmethanamine is sourced from PubChem (CID 89258846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).