[(E)-pent-1-enoxy]methylcyclopentane

C11H20O — CID 173273027

IUPAC[(E)-pent-1-enoxy]methylcyclopentane
SMILESCCC/C=C/OCC1CCCC1
InChIInChI=1S/C11H20O/c1-2-3-6-9-12-10-11-7-4-5-8-11/h6,9,11H,2-5,7-8,10H2,1H3/b9-6+
InChIKeyQQSOSMNIAJVUIQ-RMKNXTFCSA-N
MW168.28 g/mol
LogP3.51
Rot. Bonds5

About [(E)-pent-1-enoxy]methylcyclopentane

[(E)-pent-1-enoxy]methylcyclopentane (PubChem CID 173273027) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is [(E)-pent-1-enoxy]methylcyclopentane.

Molecular Properties

Compound Name[(E)-pent-1-enoxy]methylcyclopentane
PubChem CID173273027
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name[(E)-pent-1-enoxy]methylcyclopentane
SMILESCCC/C=C/OCC1CCCC1
InChIInChI=1S/C11H20O/c1-2-3-6-9-12-10-11-7-4-5-8-11/h6,9,11H,2-5,7-8,10H2,1H3/b9-6+
InChIKeyQQSOSMNIAJVUIQ-RMKNXTFCSA-N
XLogP3.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

pent-1-enoxymethylcyclodecane
CID 173273161
1-(but-1-enoxymethyl)-4-(4-pent-1-enylcyclohexyl)cyclohexane
CID 67898621
2-pent-1-enoxybutylcyclohexane
CID 57213042
(Z)-1-ethoxypent-1-ene
CID 12512190
3-pent-1-enoxybutylcyclohexane
CID 57299667
buta-1,3-dienoxymethylcyclopentane
CID 140706942
1-(but-1-enoxymethyl)-4-(4-but-1-enylcyclohexyl)cyclohexane
CID 67898747
1-(but-1-enoxymethyl)-4-(4-prop-1-enylcyclohexyl)cyclohexane
CID 67898606
5-pent-1-enoxypent-1-ene-1-thiol
CID 175457367
cyclohexanecarbaldehyde;cyclohexylmethyl formate;ethane
CID 174908022
N-(cyclopentylmethoxy)formamide
CID 23090322
ethoxymethylcyclooctane
CID 70370569

Frequently Asked Questions

What is the IUPAC name of [(E)-pent-1-enoxy]methylcyclopentane?
The IUPAC name of [(E)-pent-1-enoxy]methylcyclopentane (CID 173273027) is [(E)-pent-1-enoxy]methylcyclopentane.
What is the SMILES notation for [(E)-pent-1-enoxy]methylcyclopentane?
The canonical SMILES for [(E)-pent-1-enoxy]methylcyclopentane is CCC/C=C/OCC1CCCC1.
What is the InChIKey of [(E)-pent-1-enoxy]methylcyclopentane?
The InChIKey is QQSOSMNIAJVUIQ-RMKNXTFCSA-N. The full InChI is InChI=1S/C11H20O/c1-2-3-6-9-12-10-11-7-4-5-8-11/h6,9,11H,2-5,7-8,10H2,1H3/b9-6+.
What are the key properties of [(E)-pent-1-enoxy]methylcyclopentane?
[(E)-pent-1-enoxy]methylcyclopentane has a molecular weight of 168.28 g/mol, XLogP of 3.51, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-pent-1-enoxy]methylcyclopentane is sourced from PubChem (CID 173273027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).