1-(4-methylpent-4-enyl)naphthalene

C16H18 — CID 146002701

IUPAC1-(4-methylpent-4-enyl)naphthalene
SMILESC=C(C)CCCc1cccc2ccccc12
InChIInChI=1S/C16H18/c1-13(2)7-5-9-15-11-6-10-14-8-3-4-12-16(14)15/h3-4,6,8,10-12H,1,5,7,9H2,2H3
InChIKeyVOXDREPDANYSTK-UHFFFAOYSA-N
MW210.32 g/mol
LogP4.74
Rot. Bonds4

About 1-(4-methylpent-4-enyl)naphthalene

1-(4-methylpent-4-enyl)naphthalene (PubChem CID 146002701) has the molecular formula C16H18 and a molecular weight of 210.32 g/mol. Its IUPAC name is 1-(4-methylpent-4-enyl)naphthalene.

Molecular Properties

Compound Name1-(4-methylpent-4-enyl)naphthalene
PubChem CID146002701
Molecular FormulaC16H18
Molecular Weight210.32 g/mol
Exact Mass210.14
IUPAC Name1-(4-methylpent-4-enyl)naphthalene
SMILESC=C(C)CCCc1cccc2ccccc12
InChIInChI=1S/C16H18/c1-13(2)7-5-9-15-11-6-10-14-8-3-4-12-16(14)15/h3-4,6,8,10-12H,1,5,7,9H2,2H3
InChIKeyVOXDREPDANYSTK-UHFFFAOYSA-N
XLogP4.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 54.74
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

3-naphthalen-1-ylpropan-1-ol
CID 14711518
3-methyl-N-(naphthalen-1-ylmethyl)but-3-en-1-amine
CID 114472242
1-butylnaphthalene;ethane
CID 142087052
2-(6-naphthalen-1-ylhexan-2-ylidene)propanedinitrile
CID 11086975
2-[2,6-bis(3-methylbut-3-enyl)phenoxy]-1,3-bis(3-methylbut-3-enyl)benzene
CID 69442758
azane;1-butylnaphthalene;methane
CID 174691035
1-tetradecylnaphthalene
CID 14402128
4-naphthalen-1-ylbutanoyl 4-phenylbutanoate
CID 138543453
ethane;2-naphthalen-1-ylethanol
CID 145119048
1-[3-(3-naphthalen-1-ylpropoxy)propyl]naphthalene
CID 139748426
1-(4-fluorobutyl)naphthalene
CID 174977280
1-(4-methoxybutyl)naphthalene
CID 69278949

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpent-4-enyl)naphthalene?
The IUPAC name of 1-(4-methylpent-4-enyl)naphthalene (CID 146002701) is 1-(4-methylpent-4-enyl)naphthalene.
What is the SMILES notation for 1-(4-methylpent-4-enyl)naphthalene?
The canonical SMILES for 1-(4-methylpent-4-enyl)naphthalene is C=C(C)CCCc1cccc2ccccc12.
What is the InChIKey of 1-(4-methylpent-4-enyl)naphthalene?
The InChIKey is VOXDREPDANYSTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18/c1-13(2)7-5-9-15-11-6-10-14-8-3-4-12-16(14)15/h3-4,6,8,10-12H,1,5,7,9H2,2H3.
What are the key properties of 1-(4-methylpent-4-enyl)naphthalene?
1-(4-methylpent-4-enyl)naphthalene has a molecular weight of 210.32 g/mol, XLogP of 4.74, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpent-4-enyl)naphthalene is sourced from PubChem (CID 146002701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).