N-methyl-1-thiomorpholin-2-ylmethanamine

C6H14N2S — CID 23090239

IUPACN-methyl-1-thiomorpholin-2-ylmethanamine
SMILESCNCC1CNCCS1
InChIInChI=1S/C6H14N2S/c1-7-4-6-5-8-2-3-9-6/h6-8H,2-5H2,1H3
InChIKeyKRIKMXWPWZIKCQ-UHFFFAOYSA-N
MW146.26 g/mol
LogP-0.09
Rot. Bonds2

About N-methyl-1-thiomorpholin-2-ylmethanamine

N-methyl-1-thiomorpholin-2-ylmethanamine (PubChem CID 23090239) has the molecular formula C6H14N2S and a molecular weight of 146.26 g/mol. Its IUPAC name is N-methyl-1-thiomorpholin-2-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-thiomorpholin-2-ylmethanamine
PubChem CID23090239
Molecular FormulaC6H14N2S
Molecular Weight146.26 g/mol
Exact Mass146.09
IUPAC NameN-methyl-1-thiomorpholin-2-ylmethanamine
SMILESCNCC1CNCCS1
InChIInChI=1S/C6H14N2S/c1-7-4-6-5-8-2-3-9-6/h6-8H,2-5H2,1H3
InChIKeyKRIKMXWPWZIKCQ-UHFFFAOYSA-N
XLogP-0.09
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.26
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-thiomorpholin-2-ylmethanamine?
The IUPAC name of N-methyl-1-thiomorpholin-2-ylmethanamine (CID 23090239) is N-methyl-1-thiomorpholin-2-ylmethanamine.
What is the SMILES notation for N-methyl-1-thiomorpholin-2-ylmethanamine?
The canonical SMILES for N-methyl-1-thiomorpholin-2-ylmethanamine is CNCC1CNCCS1.
What is the InChIKey of N-methyl-1-thiomorpholin-2-ylmethanamine?
The InChIKey is KRIKMXWPWZIKCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2S/c1-7-4-6-5-8-2-3-9-6/h6-8H,2-5H2,1H3.
What are the key properties of N-methyl-1-thiomorpholin-2-ylmethanamine?
N-methyl-1-thiomorpholin-2-ylmethanamine has a molecular weight of 146.26 g/mol, XLogP of -0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-thiomorpholin-2-ylmethanamine is sourced from PubChem (CID 23090239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).