4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine

C10H19NS — CID 143342054

IUPAC4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine
SMILESC=CSC(=C(C)C)C(CC)NC
InChIInChI=1S/C10H19NS/c1-6-9(11-5)10(8(3)4)12-7-2/h7,9,11H,2,6H2,1,3-5H3
InChIKeyRHZDIQQYWMOZEL-UHFFFAOYSA-N
MW185.34 g/mol
LogP3.15
Rot. Bonds5

About 4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine

4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine (PubChem CID 143342054) has the molecular formula C10H19NS and a molecular weight of 185.34 g/mol. Its IUPAC name is 4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine.

Molecular Properties

Compound Name4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine
PubChem CID143342054
Molecular FormulaC10H19NS
Molecular Weight185.34 g/mol
Exact Mass185.12
IUPAC Name4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine
SMILESC=CSC(=C(C)C)C(CC)NC
InChIInChI=1S/C10H19NS/c1-6-9(11-5)10(8(3)4)12-7-2/h7,9,11H,2,6H2,1,3-5H3
InChIKeyRHZDIQQYWMOZEL-UHFFFAOYSA-N
XLogP3.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.34
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethenylsulfanyl-N-fluoro-5-methylhex-4-en-3-amine
CID 143343262
(E)-N-(1-ethenylsulfanylpentan-2-yl)-2-(1-fluoroethenyl)-3-methylpent-2-en-1-amine
CID 155723572
N,3-dimethyl-1-propan-2-ylsulfanylbut-3-en-2-amine
CID 79179493
(3S)-N-methyl-4-methylidene-1-methylsulfanylhex-5-en-3-amine
CID 87280201
(3S)-N,2-dimethyl-5-methylsulfanylpent-1-en-3-amine
CID 87501099
(3S)-N-ethyl-2-methyl-5-methylsulfanylpent-1-en-3-amine
CID 88539134
5,6-Dimethyl-4-methylsulfanyl-1,2,3,6-tetrahydropyridine
CID 89010968
(6R)-5-ethenyl-6-methyl-4-methylsulfanyl-1,2,3,6-tetrahydropyridine
CID 89010970
(3S)-2-methyl-5-methylsulfanyl-N-propylpent-1-en-3-amine
CID 89375942
N,2-dimethyl-5-methylsulfanylpent-1-en-3-amine
CID 89583271
1-cyclohepta-1,3,5,6-tetraen-1-yl-N-methyl-2-methylsulfanylethanamine
CID 123352641
2-methyl-5-(2-methylsulfanylethyl)-2,5-dihydro-1H-pyrrole
CID 141381307

Frequently Asked Questions

What is the IUPAC name of 4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine?
The IUPAC name of 4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine (CID 143342054) is 4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine.
What is the SMILES notation for 4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine?
The canonical SMILES for 4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine is C=CSC(=C(C)C)C(CC)NC.
What is the InChIKey of 4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine?
The InChIKey is RHZDIQQYWMOZEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NS/c1-6-9(11-5)10(8(3)4)12-7-2/h7,9,11H,2,6H2,1,3-5H3.
What are the key properties of 4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine?
4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine has a molecular weight of 185.34 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenylsulfanyl-N,5-dimethylhex-4-en-3-amine is sourced from PubChem (CID 143342054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).