5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane

C16H24 — CID 90892008

IUPAC5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane
SMILESCC1(C)CC(C=C2C=CC=C2)CC(C)(C)C1
InChIInChI=1S/C16H24/c1-15(2)10-14(11-16(3,4)12-15)9-13-7-5-6-8-13/h5-9,14H,10-12H2,1-4H3
InChIKeyMFAATRYYPPQGDC-UHFFFAOYSA-N
MW216.37 g/mol
LogP4.89
Rot. Bonds1

About 5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane

5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane (PubChem CID 90892008) has the molecular formula C16H24 and a molecular weight of 216.37 g/mol. Its IUPAC name is 5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane.

Molecular Properties

Compound Name5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane
PubChem CID90892008
Molecular FormulaC16H24
Molecular Weight216.37 g/mol
Exact Mass216.19
IUPAC Name5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane
SMILESCC1(C)CC(C=C2C=CC=C2)CC(C)(C)C1
InChIInChI=1S/C16H24/c1-15(2)10-14(11-16(3,4)12-15)9-13-7-5-6-8-13/h5-9,14H,10-12H2,1-4H3
InChIKeyMFAATRYYPPQGDC-UHFFFAOYSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.37
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane?
The IUPAC name of 5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane (CID 90892008) is 5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane.
What is the SMILES notation for 5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane?
The canonical SMILES for 5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane is CC1(C)CC(C=C2C=CC=C2)CC(C)(C)C1.
What is the InChIKey of 5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane?
The InChIKey is MFAATRYYPPQGDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24/c1-15(2)10-14(11-16(3,4)12-15)9-13-7-5-6-8-13/h5-9,14H,10-12H2,1-4H3.
What are the key properties of 5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane?
5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane has a molecular weight of 216.37 g/mol, XLogP of 4.89, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopenta-2,4-dien-1-ylidenemethyl)-1,1,3,3-tetramethylcyclohexane is sourced from PubChem (CID 90892008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).