(Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine

C7H15NS — CID 146392744

IUPAC(Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine
SMILESCCN(C)/C=C(/C)SC
InChIInChI=1S/C7H15NS/c1-5-8(3)6-7(2)9-4/h6H,5H2,1-4H3/b7-6-
InChIKeyGRFIWTVLILGJDR-SREVYHEPSA-N
MW145.27 g/mol
LogP2.16
Rot. Bonds3

About (Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine

(Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine (PubChem CID 146392744) has the molecular formula C7H15NS and a molecular weight of 145.27 g/mol. Its IUPAC name is (Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine
PubChem CID146392744
Molecular FormulaC7H15NS
Molecular Weight145.27 g/mol
Exact Mass145.09
IUPAC Name(Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine
SMILESCCN(C)/C=C(/C)SC
InChIInChI=1S/C7H15NS/c1-5-8(3)6-7(2)9-4/h6H,5H2,1-4H3/b7-6-
InChIKeyGRFIWTVLILGJDR-SREVYHEPSA-N
XLogP2.16
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.27
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine?
The IUPAC name of (Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine (CID 146392744) is (Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine.
What is the SMILES notation for (Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine?
The canonical SMILES for (Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine is CCN(C)/C=C(/C)SC.
What is the InChIKey of (Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine?
The InChIKey is GRFIWTVLILGJDR-SREVYHEPSA-N. The full InChI is InChI=1S/C7H15NS/c1-5-8(3)6-7(2)9-4/h6H,5H2,1-4H3/b7-6-.
What are the key properties of (Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine?
(Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine has a molecular weight of 145.27 g/mol, XLogP of 2.16, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-N-methyl-2-methylsulfanylprop-1-en-1-amine is sourced from PubChem (CID 146392744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).