4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene

C10H20S — CID 170369684

IUPAC4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene
SMILESC=CC(C(C)C)C(C)CSC
InChIInChI=1S/C10H20S/c1-6-10(8(2)3)9(4)7-11-5/h6,8-10H,1,7H2,2-5H3
InChIKeyJOOYRQNZHNYAJC-UHFFFAOYSA-N
MW172.34 g/mol
LogP3.44
Rot. Bonds5

About 4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene

4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene (PubChem CID 170369684) has the molecular formula C10H20S and a molecular weight of 172.34 g/mol. Its IUPAC name is 4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene.

Molecular Properties

Compound Name4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene
PubChem CID170369684
Molecular FormulaC10H20S
Molecular Weight172.34 g/mol
Exact Mass172.13
IUPAC Name4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene
SMILESC=CC(C(C)C)C(C)CSC
InChIInChI=1S/C10H20S/c1-6-10(8(2)3)9(4)7-11-5/h6,8-10H,1,7H2,2-5H3
InChIKeyJOOYRQNZHNYAJC-UHFFFAOYSA-N
XLogP3.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.34
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-ethenyl-3,5-dimethylheptane
CID 90755259
4-ethenyl-2,3,5-trimethyloctane
CID 123741658
(2S)-2,3-dimethyl-4-methylsulfanylbutan-1-ol
CID 88583257
4-methyl-6-(2-methyl-3-propan-2-ylpent-4-enyl)pyrimidin-5-amine
CID 126593372
N-[(3E)-2,3-diamino-6-methyl-7-propan-2-ylnona-1,3,8-trien-4-yl]ethanimidoyl chloride
CID 126599350
(E)-2,5-dimethylhex-3-ene;2,5-dimethyl-3-propan-2-ylhex-3-ene;4-methyl-3-propan-2-ylpent-1-ene
CID 159167513
3-methyl-1-methylsulfanylbutan-2-amine
CID 62691517
3,4-diethyl-5-methylhex-1-ene
CID 22107333
triethyl(penta-1,4-dien-3-yl)azanium
CID 22956718
N-(1-methylsulfanylpropan-2-yl)hex-5-en-2-amine
CID 104582576
(3S)-5-methylsulfanylpent-1-en-3-amine
CID 88911302
3-methylbut-1-ene;hydrobromide
CID 158395600

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene?
The IUPAC name of 4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene (CID 170369684) is 4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene.
What is the SMILES notation for 4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene?
The canonical SMILES for 4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene is C=CC(C(C)C)C(C)CSC.
What is the InChIKey of 4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene?
The InChIKey is JOOYRQNZHNYAJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20S/c1-6-10(8(2)3)9(4)7-11-5/h6,8-10H,1,7H2,2-5H3.
What are the key properties of 4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene?
4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene has a molecular weight of 172.34 g/mol, XLogP of 3.44, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-methylsulfanyl-3-propan-2-ylpent-1-ene is sourced from PubChem (CID 170369684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).