(Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene

C10H20S — CID 138484830

IUPAC(Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene
SMILESCCC(/C=C\SC(C)C)CC
InChIInChI=1S/C10H20S/c1-5-10(6-2)7-8-11-9(3)4/h7-10H,5-6H2,1-4H3/b8-7-
InChIKeyOQXJSWDPAOLNHK-FPLPWBNLSA-N
MW172.34 g/mol
LogP4.08
Rot. Bonds5

About (Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene

(Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene (PubChem CID 138484830) has the molecular formula C10H20S and a molecular weight of 172.34 g/mol. Its IUPAC name is (Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene.

Molecular Properties

Compound Name(Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene
PubChem CID138484830
Molecular FormulaC10H20S
Molecular Weight172.34 g/mol
Exact Mass172.13
IUPAC Name(Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene
SMILESCCC(/C=C\SC(C)C)CC
InChIInChI=1S/C10H20S/c1-5-10(6-2)7-8-11-9(3)4/h7-10H,5-6H2,1-4H3/b8-7-
InChIKeyOQXJSWDPAOLNHK-FPLPWBNLSA-N
XLogP4.08
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 ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene?
The IUPAC name of (Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene (CID 138484830) is (Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene.
What is the SMILES notation for (Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene?
The canonical SMILES for (Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene is CCC(/C=C\SC(C)C)CC.
What is the InChIKey of (Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene?
The InChIKey is OQXJSWDPAOLNHK-FPLPWBNLSA-N. The full InChI is InChI=1S/C10H20S/c1-5-10(6-2)7-8-11-9(3)4/h7-10H,5-6H2,1-4H3/b8-7-.
What are the key properties of (Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene?
(Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene has a molecular weight of 172.34 g/mol, XLogP of 4.08, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-ethyl-1-propan-2-ylsulfanylpent-1-ene is sourced from PubChem (CID 138484830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).