N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine

C9H25NS2 — CID 138611978

IUPACN-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine
SMILESCN(CS(C)(C)C)CS(C)(C)C
InChIInChI=1S/C9H25NS2/c1-10(8-11(2,3)4)9-12(5,6)7/h8-9H2,1-7H3
InChIKeyDJWLKFPNEGAEJI-UHFFFAOYSA-N
MW211.44 g/mol
LogP2.22
Rot. Bonds4

About N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine

N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine (PubChem CID 138611978) has the molecular formula C9H25NS2 and a molecular weight of 211.44 g/mol. Its IUPAC name is N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine
PubChem CID138611978
Molecular FormulaC9H25NS2
Molecular Weight211.44 g/mol
Exact Mass211.14
IUPAC NameN-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine
SMILESCN(CS(C)(C)C)CS(C)(C)C
InChIInChI=1S/C9H25NS2/c1-10(8-11(2,3)4)9-12(5,6)7/h8-9H2,1-7H3
InChIKeyDJWLKFPNEGAEJI-UHFFFAOYSA-N
XLogP2.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.44
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine?
The IUPAC name of N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine (CID 138611978) is N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine.
What is the SMILES notation for N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine?
The canonical SMILES for N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine is CN(CS(C)(C)C)CS(C)(C)C.
What is the InChIKey of N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine?
The InChIKey is DJWLKFPNEGAEJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H25NS2/c1-10(8-11(2,3)4)9-12(5,6)7/h8-9H2,1-7H3.
What are the key properties of N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine?
N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine has a molecular weight of 211.44 g/mol, XLogP of 2.22, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(trimethyl-λ4-sulfanyl)-N-[(trimethyl-λ4-sulfanyl)methyl]methanamine is sourced from PubChem (CID 138611978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).