N-methyl-1-(thiolan-2-ylidene)methanamine

C6H11NS — CID 91211644

IUPACN-methyl-1-(thiolan-2-ylidene)methanamine
SMILESCNC=C1CCCS1
InChIInChI=1S/C6H11NS/c1-7-5-6-3-2-4-8-6/h5,7H,2-4H2,1H3
InChIKeyUEDHBZDCMNSDFR-UHFFFAOYSA-N
MW129.23 g/mol
LogP1.57
Rot. Bonds1

About N-methyl-1-(thiolan-2-ylidene)methanamine

N-methyl-1-(thiolan-2-ylidene)methanamine (PubChem CID 91211644) has the molecular formula C6H11NS and a molecular weight of 129.23 g/mol. Its IUPAC name is N-methyl-1-(thiolan-2-ylidene)methanamine.

Molecular Properties

Compound NameN-methyl-1-(thiolan-2-ylidene)methanamine
PubChem CID91211644
Molecular FormulaC6H11NS
Molecular Weight129.23 g/mol
Exact Mass129.06
IUPAC NameN-methyl-1-(thiolan-2-ylidene)methanamine
SMILESCNC=C1CCCS1
InChIInChI=1S/C6H11NS/c1-7-5-6-3-2-4-8-6/h5,7H,2-4H2,1H3
InChIKeyUEDHBZDCMNSDFR-UHFFFAOYSA-N
XLogP1.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.23
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(thiolan-2-ylidene)methanamine?
The IUPAC name of N-methyl-1-(thiolan-2-ylidene)methanamine (CID 91211644) is N-methyl-1-(thiolan-2-ylidene)methanamine.
What is the SMILES notation for N-methyl-1-(thiolan-2-ylidene)methanamine?
The canonical SMILES for N-methyl-1-(thiolan-2-ylidene)methanamine is CNC=C1CCCS1.
What is the InChIKey of N-methyl-1-(thiolan-2-ylidene)methanamine?
The InChIKey is UEDHBZDCMNSDFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NS/c1-7-5-6-3-2-4-8-6/h5,7H,2-4H2,1H3.
What are the key properties of N-methyl-1-(thiolan-2-ylidene)methanamine?
N-methyl-1-(thiolan-2-ylidene)methanamine has a molecular weight of 129.23 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(thiolan-2-ylidene)methanamine is sourced from PubChem (CID 91211644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).