(Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine

C10H19NS — CID 130224145

IUPAC(Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine
SMILESCN/C=C(\SC=C(C)C)C(C)C
InChIInChI=1S/C10H19NS/c1-8(2)7-12-10(6-11-5)9(3)4/h6-7,9,11H,1-5H3/b10-6-
InChIKeyIEAZWZBIPRIJDW-POHAHGRESA-N
MW185.34 g/mol
LogP3.36
Rot. Bonds4

About (Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine

(Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine (PubChem CID 130224145) has the molecular formula C10H19NS and a molecular weight of 185.34 g/mol. Its IUPAC name is (Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine
PubChem CID130224145
Molecular FormulaC10H19NS
Molecular Weight185.34 g/mol
Exact Mass185.12
IUPAC Name(Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine
SMILESCN/C=C(\SC=C(C)C)C(C)C
InChIInChI=1S/C10H19NS/c1-8(2)7-12-10(6-11-5)9(3)4/h6-7,9,11H,1-5H3/b10-6-
InChIKeyIEAZWZBIPRIJDW-POHAHGRESA-N
XLogP3.36
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.34
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Launch Full Analysis

Related Compounds

2,5-Di(propan-2-yl)-2,3-dihydro-1,3-thiazole
CID 58092319
(E)-2-methyl-4-methylsulfanylbut-1-en-1-amine
CID 88936278
(Z)-3-methyl-2-methylsulfanyl-N-prop-1-en-2-ylbut-1-en-1-amine
CID 126583601
(Z)-2-ethenylsulfanyl-N,3-dimethylbut-1-en-1-amine
CID 126626583
(Z)-2-butan-2-ylsulfanyl-3-methylbut-1-en-1-amine
CID 129207404
(Z)-N,3-dimethyl-2-methylsulfanylbut-1-en-1-amine
CID 132011706
(E)-N-[3-(2,2-dimethylpropylsulfanyl)propyl]-2,3,3-trimethylbut-1-en-1-amine
CID 138623006
(Z)-2-but-2-ynylsulfanyl-N,3-dimethylbut-1-en-1-amine
CID 138705409
5-Propan-2-yl-2,3-dihydro-1,3-thiazole
CID 146619250
(Z)-2-ethylsulfanyl-N,3,3-trimethylbut-1-en-1-amine
CID 146640692
2-propan-2-yl-4H-1,4-thiazine
CID 147580596
(Z)-N-ethyl-3,3-dimethyl-2-propylsulfanylbut-1-en-1-amine
CID 155448890

Frequently Asked Questions

What is the IUPAC name of (Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine?
The IUPAC name of (Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine (CID 130224145) is (Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine.
What is the SMILES notation for (Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine?
The canonical SMILES for (Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine is CN/C=C(\SC=C(C)C)C(C)C.
What is the InChIKey of (Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine?
The InChIKey is IEAZWZBIPRIJDW-POHAHGRESA-N. The full InChI is InChI=1S/C10H19NS/c1-8(2)7-12-10(6-11-5)9(3)4/h6-7,9,11H,1-5H3/b10-6-.
What are the key properties of (Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine?
(Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine has a molecular weight of 185.34 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,3-dimethyl-2-(2-methylprop-1-enylsulfanyl)but-1-en-1-amine is sourced from PubChem (CID 130224145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).