1-pent-3-enyl-4-propylcyclohexane

C14H26 — CID 72599468

IUPAC1-pent-3-enyl-4-propylcyclohexane
SMILESCC=CCCC1CCC(CCC)CC1
InChIInChI=1S/C14H26/c1-3-5-6-8-14-11-9-13(7-4-2)10-12-14/h3,5,13-14H,4,6-12H2,1-2H3
InChIKeyXUXVWXPVPAJWOL-UHFFFAOYSA-N
MW194.36 g/mol
LogP4.95
Rot. Bonds5

About 1-pent-3-enyl-4-propylcyclohexane

1-pent-3-enyl-4-propylcyclohexane (PubChem CID 72599468) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is 1-pent-3-enyl-4-propylcyclohexane.

Molecular Properties

Compound Name1-pent-3-enyl-4-propylcyclohexane
PubChem CID72599468
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name1-pent-3-enyl-4-propylcyclohexane
SMILESCC=CCCC1CCC(CCC)CC1
InChIInChI=1S/C14H26/c1-3-5-6-8-14-11-9-13(7-4-2)10-12-14/h3,5,13-14H,4,6-12H2,1-2H3
InChIKeyXUXVWXPVPAJWOL-UHFFFAOYSA-N
XLogP4.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.36
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

methane;1-methyl-4-[(E)-pent-3-enyl]cyclohexane
CID 158715477
2-[(E)-pent-3-enyl]-6-[4-(6-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)cyclohexyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 139866166
1-ethyl-4-[4-[4-[(E)-pent-3-enyl]cyclohexyl]butyl]cyclohexane
CID 19070114
methane;1-methyl-4-[4-[(E)-pent-3-enyl]cyclohexyl]cyclohexane
CID 145124798
1-butyl-4-[(E)-prop-1-enyl]cyclohexane;1-decyl-4-[(E)-prop-1-enyl]cyclohexane;1-heptyl-4-[(E)-prop-1-enyl]cyclohexane;1-hexyl-4-[(E)-prop-1-enyl]cyclohexane;1-nonyl-4-[(E)-prop-1-enyl]cyclohexane;1-octyl-4-[(E)-prop-1-enyl]cyclohexane;1-[(E)-pent-3-enyl]-4-[(E)-prop-1-enyl]cyclohexane;1-pentyl-4-[(E)-prop-1-enyl]cyclohexane;1-[(E)-prop-1-enyl]-4-propylcyclohexane
CID 159199082
1-prop-1-enyl-4-[4-[4-(4-propylcyclohexyl)cyclohexyl]but-1-enyl]cyclohexane
CID 54574523
1-ethyl-4-[(E)-4-[4-[(E)-pent-3-enyl]cyclohexyl]but-1-enyl]cyclohexane
CID 19070206
1-[(E)-non-1-enyl]-4-[(E)-pent-3-enyl]cyclohexane
CID 140650646
1-non-1-enyl-4-pent-3-enylcyclohexane
CID 123569351
1-hexoxy-4-[2-[4-[(E)-pent-3-enyl]cyclohexyl]ethyl]cyclohexane
CID 67806291
1-pent-3-enyl-4-(4-prop-1-enylcyclohexyl)cyclohexane
CID 54021593
1-[(E)-pent-3-enyl]-4-(4-pent-1-ynylcyclohexyl)cyclohexane
CID 173364275

Frequently Asked Questions

What is the IUPAC name of 1-pent-3-enyl-4-propylcyclohexane?
The IUPAC name of 1-pent-3-enyl-4-propylcyclohexane (CID 72599468) is 1-pent-3-enyl-4-propylcyclohexane.
What is the SMILES notation for 1-pent-3-enyl-4-propylcyclohexane?
The canonical SMILES for 1-pent-3-enyl-4-propylcyclohexane is CC=CCCC1CCC(CCC)CC1.
What is the InChIKey of 1-pent-3-enyl-4-propylcyclohexane?
The InChIKey is XUXVWXPVPAJWOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26/c1-3-5-6-8-14-11-9-13(7-4-2)10-12-14/h3,5,13-14H,4,6-12H2,1-2H3.
What are the key properties of 1-pent-3-enyl-4-propylcyclohexane?
1-pent-3-enyl-4-propylcyclohexane has a molecular weight of 194.36 g/mol, XLogP of 4.95, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pent-3-enyl-4-propylcyclohexane is sourced from PubChem (CID 72599468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).