3-cyclopropylhexan-2-ylidenecyclopentane

C14H24 — CID 123813212

IUPAC3-cyclopropylhexan-2-ylidenecyclopentane
SMILESCCCC(C(C)=C1CCCC1)C1CC1
InChIInChI=1S/C14H24/c1-3-6-14(13-9-10-13)11(2)12-7-4-5-8-12/h13-14H,3-10H2,1-2H3
InChIKeyTVAYETHKRMHADU-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.70
Rot. Bonds4

About 3-cyclopropylhexan-2-ylidenecyclopentane

3-cyclopropylhexan-2-ylidenecyclopentane (PubChem CID 123813212) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 3-cyclopropylhexan-2-ylidenecyclopentane.

Molecular Properties

Compound Name3-cyclopropylhexan-2-ylidenecyclopentane
PubChem CID123813212
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name3-cyclopropylhexan-2-ylidenecyclopentane
SMILESCCCC(C(C)=C1CCCC1)C1CC1
InChIInChI=1S/C14H24/c1-3-6-14(13-9-10-13)11(2)12-7-4-5-8-12/h13-14H,3-10H2,1-2H3
InChIKeyTVAYETHKRMHADU-UHFFFAOYSA-N
XLogP4.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.70
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 3-cyclopropylhexan-2-ylidenecyclopentane?
The IUPAC name of 3-cyclopropylhexan-2-ylidenecyclopentane (CID 123813212) is 3-cyclopropylhexan-2-ylidenecyclopentane.
What is the SMILES notation for 3-cyclopropylhexan-2-ylidenecyclopentane?
The canonical SMILES for 3-cyclopropylhexan-2-ylidenecyclopentane is CCCC(C(C)=C1CCCC1)C1CC1.
What is the InChIKey of 3-cyclopropylhexan-2-ylidenecyclopentane?
The InChIKey is TVAYETHKRMHADU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-3-6-14(13-9-10-13)11(2)12-7-4-5-8-12/h13-14H,3-10H2,1-2H3.
What are the key properties of 3-cyclopropylhexan-2-ylidenecyclopentane?
3-cyclopropylhexan-2-ylidenecyclopentane has a molecular weight of 192.35 g/mol, XLogP of 4.70, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropylhexan-2-ylidenecyclopentane is sourced from PubChem (CID 123813212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).