5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine

C10H19NS — CID 169139896

IUPAC5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine
SMILESC=CSC(=C)C(C)CC(C)NC
InChIInChI=1S/C10H19NS/c1-6-12-10(4)8(2)7-9(3)11-5/h6,8-9,11H,1,4,7H2,2-3,5H3
InChIKeyMGOLUFXZPMWLGD-UHFFFAOYSA-N
MW185.34 g/mol
LogP3.01
Rot. Bonds6

About 5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine

5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine (PubChem CID 169139896) has the molecular formula C10H19NS and a molecular weight of 185.34 g/mol. Its IUPAC name is 5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine.

Molecular Properties

Compound Name5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine
PubChem CID169139896
Molecular FormulaC10H19NS
Molecular Weight185.34 g/mol
Exact Mass185.12
IUPAC Name5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine
SMILESC=CSC(=C)C(C)CC(C)NC
InChIInChI=1S/C10H19NS/c1-6-12-10(4)8(2)7-9(3)11-5/h6,8-9,11H,1,4,7H2,2-3,5H3
InChIKeyMGOLUFXZPMWLGD-UHFFFAOYSA-N
XLogP3.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.34
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N,2-dipropyl-3H-thiophen-3-amine
CID 57027759
2-methyl-N-[(2-methyl-3H-thiophen-2-yl)methyl]propan-1-amine
CID 57186297
N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine
CID 57262193
N-[(2-methyl-3H-thiophen-2-yl)methyl]propan-2-amine
CID 57284310
(3S)-N,2-dimethyl-5-methylsulfanylpent-1-en-3-amine
CID 87501099
(3S)-N-methyl-4-methylidene-1-methylsulfanylhexan-3-amine
CID 88543586
(3S)-N,5-dimethyl-4-methylidene-1-methylsulfanylhexan-3-amine
CID 88936056
(3S)-2-methyl-5-methylsulfanyl-N-[(2R)-pentan-2-yl]pent-1-en-3-amine
CID 89062407
1-(2,3-dihydrothiophen-3-yl)-N-methylethanamine
CID 89068660
2-[2-(2-aminoethylsulfanyl)prop-2-enyl]-1-N-methylbutane-1,3-diamine
CID 89246863
N,2-dimethyl-5-methylsulfanylpent-1-en-3-amine
CID 89583271
N-methyl-4-methylidene-1-methylsulfanylhexan-3-amine
CID 89738367

Frequently Asked Questions

What is the IUPAC name of 5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine?
The IUPAC name of 5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine (CID 169139896) is 5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine.
What is the SMILES notation for 5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine?
The canonical SMILES for 5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine is C=CSC(=C)C(C)CC(C)NC.
What is the InChIKey of 5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine?
The InChIKey is MGOLUFXZPMWLGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NS/c1-6-12-10(4)8(2)7-9(3)11-5/h6,8-9,11H,1,4,7H2,2-3,5H3.
What are the key properties of 5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine?
5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine has a molecular weight of 185.34 g/mol, XLogP of 3.01, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenylsulfanyl-N,4-dimethylhex-5-en-2-amine is sourced from PubChem (CID 169139896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).