N-methyl-1-methylsulfanylbutan-2-amine

C6H15NS — CID 20715135

IUPACN-methyl-1-methylsulfanylbutan-2-amine
SMILESCCC(CSC)NC
InChIInChI=1S/C6H15NS/c1-4-6(7-2)5-8-3/h6-7H,4-5H2,1-3H3
InChIKeyLDPYPWJIRZXMOE-UHFFFAOYSA-N
MW133.26 g/mol
LogP1.35
Rot. Bonds4

About N-methyl-1-methylsulfanylbutan-2-amine

N-methyl-1-methylsulfanylbutan-2-amine (PubChem CID 20715135) has the molecular formula C6H15NS and a molecular weight of 133.26 g/mol. Its IUPAC name is N-methyl-1-methylsulfanylbutan-2-amine.

Molecular Properties

Compound NameN-methyl-1-methylsulfanylbutan-2-amine
PubChem CID20715135
Molecular FormulaC6H15NS
Molecular Weight133.26 g/mol
Exact Mass133.09
IUPAC NameN-methyl-1-methylsulfanylbutan-2-amine
SMILESCCC(CSC)NC
InChIInChI=1S/C6H15NS/c1-4-6(7-2)5-8-3/h6-7H,4-5H2,1-3H3
InChIKeyLDPYPWJIRZXMOE-UHFFFAOYSA-N
XLogP1.35
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.26
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-methylsulfanylbutan-2-amine?
The IUPAC name of N-methyl-1-methylsulfanylbutan-2-amine (CID 20715135) is N-methyl-1-methylsulfanylbutan-2-amine.
What is the SMILES notation for N-methyl-1-methylsulfanylbutan-2-amine?
The canonical SMILES for N-methyl-1-methylsulfanylbutan-2-amine is CCC(CSC)NC.
What is the InChIKey of N-methyl-1-methylsulfanylbutan-2-amine?
The InChIKey is LDPYPWJIRZXMOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NS/c1-4-6(7-2)5-8-3/h6-7H,4-5H2,1-3H3.
What are the key properties of N-methyl-1-methylsulfanylbutan-2-amine?
N-methyl-1-methylsulfanylbutan-2-amine has a molecular weight of 133.26 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-methylsulfanylbutan-2-amine is sourced from PubChem (CID 20715135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).