2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene

C23H30 — CID 139863616

IUPAC2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene
SMILESCCC/C=C/C1CCC(c2ccc3cc(CC)ccc3c2)CC1
InChIInChI=1S/C23H30/c1-3-5-6-7-19-9-11-20(12-10-19)22-15-14-21-16-18(4-2)8-13-23(21)17-22/h6-8,13-17,19-20H,3-5,9-12H2,1-2H3/b7-6+
InChIKeyAKGOZJKIMYVBKE-VOTSOKGWSA-N
MW306.49 g/mol
LogP7.03
Rot. Bonds5

About 2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene

2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene (PubChem CID 139863616) has the molecular formula C23H30 and a molecular weight of 306.49 g/mol. Its IUPAC name is 2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene.

Molecular Properties

Compound Name2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene
PubChem CID139863616
Molecular FormulaC23H30
Molecular Weight306.49 g/mol
Exact Mass306.23
IUPAC Name2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene
SMILESCCC/C=C/C1CCC(c2ccc3cc(CC)ccc3c2)CC1
InChIInChI=1S/C23H30/c1-3-5-6-7-19-9-11-20(12-10-19)22-15-14-21-16-18(4-2)8-13-23(21)17-22/h6-8,13-17,19-20H,3-5,9-12H2,1-2H3/b7-6+
InChIKeyAKGOZJKIMYVBKE-VOTSOKGWSA-N
XLogP7.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.49
LogP ≤ 57.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethyl-6-[2-[4-[4-[(E)-pent-1-enyl]cyclohexyl]phenyl]ethyl]naphthalene
CID 139862535
2-[2-[4-[4-[(E)-pent-1-enyl]cyclohexyl]phenyl]ethyl]-6-propylnaphthalene
CID 139863895
2-[4-[2-[4-[(E)-pent-1-enyl]cyclohexyl]ethyl]cyclohexyl]-6-pentylnaphthalene
CID 139861782
2-[2-[4-[4-[(E)-pent-1-enyl]cyclohexyl]phenyl]ethyl]-6-pentylnaphthalene
CID 139864116
2-ethyl-6-[4-[4-[(E)-prop-1-enyl]cyclohexyl]phenyl]naphthalene
CID 139860723
2-[4-[2-[4-[(E)-pent-1-enyl]cyclohexyl]ethyl]cyclohexyl]-6-prop-2-enoxynaphthalene
CID 139862355
4-[4-[(E)-pent-1-enyl]cyclohexyl]aniline
CID 18642462
2-ethyl-6-[4-[2-(4-ethylcyclohexyl)ethyl]cyclohexyl]naphthalene
CID 139862906
1-(4-pent-1-enylcyclohexyl)-4-(propoxymethyl)benzene
CID 54131029
1-[4-[(E)-pent-1-enyl]cyclohexyl]-4-(4-propylcyclohexyl)benzene
CID 19899800
4-(4-pent-1-enylcyclohexyl)benzoic acid
CID 54142034
1,2-difluoro-4-[4-[4-[(E)-hept-1-enyl]cyclohexyl]cyclohexyl]benzene
CID 19779944

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene?
The IUPAC name of 2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene (CID 139863616) is 2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene.
What is the SMILES notation for 2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene?
The canonical SMILES for 2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene is CCC/C=C/C1CCC(c2ccc3cc(CC)ccc3c2)CC1.
What is the InChIKey of 2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene?
The InChIKey is AKGOZJKIMYVBKE-VOTSOKGWSA-N. The full InChI is InChI=1S/C23H30/c1-3-5-6-7-19-9-11-20(12-10-19)22-15-14-21-16-18(4-2)8-13-23(21)17-22/h6-8,13-17,19-20H,3-5,9-12H2,1-2H3/b7-6+.
What are the key properties of 2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene?
2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene has a molecular weight of 306.49 g/mol, XLogP of 7.03, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-[4-[(E)-pent-1-enyl]cyclohexyl]naphthalene is sourced from PubChem (CID 139863616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).