1-pent-1-en-3-yloxypentane

C10H20O — CID 88898435

IUPAC1-pent-1-en-3-yloxypentane
SMILESC=CC(CC)OCCCCC
InChIInChI=1S/C10H20O/c1-4-7-8-9-11-10(5-2)6-3/h5,10H,2,4,6-9H2,1,3H3
InChIKeyMIGCCGCSUCSQDY-UHFFFAOYSA-N
MW156.27 g/mol
LogP3.16
Rot. Bonds7

About 1-pent-1-en-3-yloxypentane

1-pent-1-en-3-yloxypentane (PubChem CID 88898435) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 1-pent-1-en-3-yloxypentane.

Molecular Properties

Compound Name1-pent-1-en-3-yloxypentane
PubChem CID88898435
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name1-pent-1-en-3-yloxypentane
SMILESC=CC(CC)OCCCCC
InChIInChI=1S/C10H20O/c1-4-7-8-9-11-10(5-2)6-3/h5,10H,2,4,6-9H2,1,3H3
InChIKeyMIGCCGCSUCSQDY-UHFFFAOYSA-N
XLogP3.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-octa-1,7-dien-3-yloxyoctane
CID 139990053
3-propoxynonadec-1-ene
CID 87204997
3-(2-nitrosoethoxy)pent-1-ene
CID 90726353
1-[2-(2-butoxybut-3-enoxy)but-3-enoxy]prop-2-en-1-ol
CID 88911865
3-oct-1-en-3-yloxyoct-1-ene
CID 21413587
ethene;1-prop-2-enoxypentane;hydrate
CID 174881313
1-pentoxyprop-2-enyl formate
CID 87679906
3-(3-methylbut-2-enoxy)pent-1-ene
CID 175435022
dipentoxymethyl(ethenyl)silane
CID 123219500
2-dodec-1-en-3-yloxyethyl hydrogen sulfate
CID 87607745
but-1-ene;1-pentoxypropane-1-sulfonic acid
CID 174804840
3-methoxy-10-octoxydec-1-ene
CID 141054986

Frequently Asked Questions

What is the IUPAC name of 1-pent-1-en-3-yloxypentane?
The IUPAC name of 1-pent-1-en-3-yloxypentane (CID 88898435) is 1-pent-1-en-3-yloxypentane.
What is the SMILES notation for 1-pent-1-en-3-yloxypentane?
The canonical SMILES for 1-pent-1-en-3-yloxypentane is C=CC(CC)OCCCCC.
What is the InChIKey of 1-pent-1-en-3-yloxypentane?
The InChIKey is MIGCCGCSUCSQDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-4-7-8-9-11-10(5-2)6-3/h5,10H,2,4,6-9H2,1,3H3.
What are the key properties of 1-pent-1-en-3-yloxypentane?
1-pent-1-en-3-yloxypentane has a molecular weight of 156.27 g/mol, XLogP of 3.16, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pent-1-en-3-yloxypentane is sourced from PubChem (CID 88898435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).