1-[(Z)-hept-1-enyl]naphthalene

C17H20 — CID 11746284

IUPAC1-[(Z)-hept-1-enyl]naphthalene
SMILESCCCCC/C=C\c1cccc2ccccc12
InChIInChI=1S/C17H20/c1-2-3-4-5-6-10-15-12-9-13-16-11-7-8-14-17(15)16/h6-14H,2-5H2,1H3/b10-6-
InChIKeyBNDRMOGOXQCVEV-POHAHGRESA-N
MW224.35 g/mol
LogP5.43
Rot. Bonds5

About 1-[(Z)-hept-1-enyl]naphthalene

1-[(Z)-hept-1-enyl]naphthalene (PubChem CID 11746284) has the molecular formula C17H20 and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-[(Z)-hept-1-enyl]naphthalene.

Molecular Properties

Compound Name1-[(Z)-hept-1-enyl]naphthalene
PubChem CID11746284
Molecular FormulaC17H20
Molecular Weight224.35 g/mol
Exact Mass224.16
IUPAC Name1-[(Z)-hept-1-enyl]naphthalene
SMILESCCCCC/C=C\c1cccc2ccccc12
InChIInChI=1S/C17H20/c1-2-3-4-5-6-10-15-12-9-13-16-11-7-8-14-17(15)16/h6-14H,2-5H2,1H3/b10-6-
InChIKeyBNDRMOGOXQCVEV-POHAHGRESA-N
XLogP5.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500224.35
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1-[(Z)-hept-1-enyl]naphthalene with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-hept-1-enyl]naphthalene?
The IUPAC name of 1-[(Z)-hept-1-enyl]naphthalene (CID 11746284) is 1-[(Z)-hept-1-enyl]naphthalene.
What is the SMILES notation for 1-[(Z)-hept-1-enyl]naphthalene?
The canonical SMILES for 1-[(Z)-hept-1-enyl]naphthalene is CCCCC/C=C\c1cccc2ccccc12.
What is the InChIKey of 1-[(Z)-hept-1-enyl]naphthalene?
The InChIKey is BNDRMOGOXQCVEV-POHAHGRESA-N. The full InChI is InChI=1S/C17H20/c1-2-3-4-5-6-10-15-12-9-13-16-11-7-8-14-17(15)16/h6-14H,2-5H2,1H3/b10-6-.
What are the key properties of 1-[(Z)-hept-1-enyl]naphthalene?
1-[(Z)-hept-1-enyl]naphthalene has a molecular weight of 224.35 g/mol, XLogP of 5.43, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-hept-1-enyl]naphthalene is sourced from PubChem (CID 11746284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).