(1Z)-3-methylcyclopentadecene

C16H30 — CID 140520640

IUPAC(1Z)-3-methylcyclopentadecene
SMILESCC1/C=C\CCCCCCCCCCCC1
InChIInChI=1S/C16H30/c1-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-16/h12,14,16H,2-11,13,15H2,1H3/b14-12-
InChIKeyCAHBWTKATBUYHO-OWBHPGMISA-N
MW222.42 g/mol
LogP5.87
Rot. Bonds

About (1Z)-3-methylcyclopentadecene

(1Z)-3-methylcyclopentadecene (PubChem CID 140520640) has the molecular formula C16H30 and a molecular weight of 222.42 g/mol. Its IUPAC name is (1Z)-3-methylcyclopentadecene.

Molecular Properties

Compound Name(1Z)-3-methylcyclopentadecene
PubChem CID140520640
Molecular FormulaC16H30
Molecular Weight222.42 g/mol
Exact Mass222.23
IUPAC Name(1Z)-3-methylcyclopentadecene
SMILESCC1/C=C\CCCCCCCCCCCC1
InChIInChI=1S/C16H30/c1-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-16/h12,14,16H,2-11,13,15H2,1H3/b14-12-
InChIKeyCAHBWTKATBUYHO-OWBHPGMISA-N
XLogP5.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500222.42
LogP ≤ 55.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1Z)-3-methylcyclopentadecene?
The IUPAC name of (1Z)-3-methylcyclopentadecene (CID 140520640) is (1Z)-3-methylcyclopentadecene.
What is the SMILES notation for (1Z)-3-methylcyclopentadecene?
The canonical SMILES for (1Z)-3-methylcyclopentadecene is CC1/C=C\CCCCCCCCCCCC1.
What is the InChIKey of (1Z)-3-methylcyclopentadecene?
The InChIKey is CAHBWTKATBUYHO-OWBHPGMISA-N. The full InChI is InChI=1S/C16H30/c1-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-16/h12,14,16H,2-11,13,15H2,1H3/b14-12-.
What are the key properties of (1Z)-3-methylcyclopentadecene?
(1Z)-3-methylcyclopentadecene has a molecular weight of 222.42 g/mol, XLogP of 5.87, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-3-methylcyclopentadecene is sourced from PubChem (CID 140520640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).