(Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine

C6H13NS — CID 139565675

IUPAC(Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine
SMILESCNC/C(C)=C\SC
InChIInChI=1S/C6H13NS/c1-6(4-7-2)5-8-3/h5,7H,4H2,1-3H3/b6-5-
InChIKeyRZQNVFFSOMBYME-WAYWQWQTSA-N
MW131.24 g/mol
LogP1.47
Rot. Bonds3

About (Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine

(Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine (PubChem CID 139565675) has the molecular formula C6H13NS and a molecular weight of 131.24 g/mol. Its IUPAC name is (Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine.

Molecular Properties

Compound Name(Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine
PubChem CID139565675
Molecular FormulaC6H13NS
Molecular Weight131.24 g/mol
Exact Mass131.08
IUPAC Name(Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine
SMILESCNC/C(C)=C\SC
InChIInChI=1S/C6H13NS/c1-6(4-7-2)5-8-3/h5,7H,4H2,1-3H3/b6-5-
InChIKeyRZQNVFFSOMBYME-WAYWQWQTSA-N
XLogP1.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.24
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylsulfanylethyl)-2-methylprop-2-en-1-amine
CID 60061029
2-methyl-N-(2-methylsulfanylethyl)prop-2-en-1-amine
CID 60695349
2-methyl-N-(3-methylsulfanylpropyl)prop-2-en-1-amine
CID 63967567
N-methyl-2-methylsulfanylprop-2-en-1-amine
CID 88989340
S-[(E)-3-(ethylamino)-2-methylprop-1-enyl]thiohydroxylamine
CID 89243600
3-Ethenylsulfanyl-2-methylprop-2-en-1-amine
CID 123604753
2-methyl-N-(1-methylsulfanylethyl)prop-2-en-1-amine
CID 123854918
N,2-dimethyl-1-propan-2-ylsulfanylprop-2-en-1-amine
CID 124201240
[(2,5-Dihydrothiophen-3-yl)methyl](methyl)amine
CID 125424518
(E)-3-ethenylsulfanyl-2-methylprop-2-en-1-amine
CID 130178861
(2-Methylbuta-2,3-dienylamino)methanethiol
CID 134316387
2-Methyl-1-(methylamino)prop-2-ene-1-thiol
CID 138664347

Frequently Asked Questions

What is the IUPAC name of (Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine?
The IUPAC name of (Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine (CID 139565675) is (Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine.
What is the SMILES notation for (Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine?
The canonical SMILES for (Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine is CNC/C(C)=C\SC.
What is the InChIKey of (Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine?
The InChIKey is RZQNVFFSOMBYME-WAYWQWQTSA-N. The full InChI is InChI=1S/C6H13NS/c1-6(4-7-2)5-8-3/h5,7H,4H2,1-3H3/b6-5-.
What are the key properties of (Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine?
(Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine has a molecular weight of 131.24 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,2-dimethyl-3-methylsulfanylprop-2-en-1-amine is sourced from PubChem (CID 139565675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).