(Z)-2-methylsulfanylprop-1-en-1-amine

C4H9NS — CID 129287514

IUPAC(Z)-2-methylsulfanylprop-1-en-1-amine
SMILESCS/C(C)=C\N
InChIInChI=1S/C4H9NS/c1-4(3-5)6-2/h3H,5H2,1-2H3/b4-3-
InChIKeyBUEWFEZCAYNOFG-ARJAWSKDSA-N
MW103.19 g/mol
LogP1.17
Rot. Bonds1

About (Z)-2-methylsulfanylprop-1-en-1-amine

(Z)-2-methylsulfanylprop-1-en-1-amine (PubChem CID 129287514) has the molecular formula C4H9NS and a molecular weight of 103.19 g/mol. Its IUPAC name is (Z)-2-methylsulfanylprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-2-methylsulfanylprop-1-en-1-amine
PubChem CID129287514
Molecular FormulaC4H9NS
Molecular Weight103.19 g/mol
Exact Mass103.05
IUPAC Name(Z)-2-methylsulfanylprop-1-en-1-amine
SMILESCS/C(C)=C\N
InChIInChI=1S/C4H9NS/c1-4(3-5)6-2/h3H,5H2,1-2H3/b4-3-
InChIKeyBUEWFEZCAYNOFG-ARJAWSKDSA-N
XLogP1.17
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.19
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-methylsulfanylprop-1-en-1-amine?
The IUPAC name of (Z)-2-methylsulfanylprop-1-en-1-amine (CID 129287514) is (Z)-2-methylsulfanylprop-1-en-1-amine.
What is the SMILES notation for (Z)-2-methylsulfanylprop-1-en-1-amine?
The canonical SMILES for (Z)-2-methylsulfanylprop-1-en-1-amine is CS/C(C)=C\N.
What is the InChIKey of (Z)-2-methylsulfanylprop-1-en-1-amine?
The InChIKey is BUEWFEZCAYNOFG-ARJAWSKDSA-N. The full InChI is InChI=1S/C4H9NS/c1-4(3-5)6-2/h3H,5H2,1-2H3/b4-3-.
What are the key properties of (Z)-2-methylsulfanylprop-1-en-1-amine?
(Z)-2-methylsulfanylprop-1-en-1-amine has a molecular weight of 103.19 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-methylsulfanylprop-1-en-1-amine is sourced from PubChem (CID 129287514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).