[(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene

C23H24 — CID 143525147

IUPAC[(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene
SMILESC=CC.CCC1=CC(=C(c2ccccc2)c2ccccc2)C=C1
InChIInChI=1S/C20H18.C3H6/c1-2-16-13-14-19(15-16)20(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-3-2/h3-15H,2H2,1H3;3H,1H2,2H3
InChIKeyHJHMCAPJRDJZNH-UHFFFAOYSA-N
MW300.45 g/mol
LogP6.59
Rot. Bonds3

About [(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene

[(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene (PubChem CID 143525147) has the molecular formula C23H24 and a molecular weight of 300.45 g/mol. Its IUPAC name is [(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene.

Molecular Properties

Compound Name[(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene
PubChem CID143525147
Molecular FormulaC23H24
Molecular Weight300.45 g/mol
Exact Mass300.19
IUPAC Name[(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene
SMILESC=CC.CCC1=CC(=C(c2ccccc2)c2ccccc2)C=C1
InChIInChI=1S/C20H18.C3H6/c1-2-16-13-14-19(15-16)20(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-3-2/h3-15H,2H2,1H3;3H,1H2,2H3
InChIKeyHJHMCAPJRDJZNH-UHFFFAOYSA-N
XLogP6.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.45
LogP ≤ 56.59
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

2-ethyl-5-propan-2-ylidenecyclopenta-1,3-diene
CID 12934680
(3-benzhydrylidenecyclopenta-1,4-dien-1-yl)benzene
CID 22327814
[(E)-but-2-en-2-yl]benzene;ethane;propane
CID 144534728
ethenamine;prop-1-en-2-ylbenzene
CID 172805831
4-benzhydrylidenecyclohexa-2,5-dien-1-imine
CID 67679531
1,3-bis(ethenyl)-2-ethylbenzene;prop-1-en-2-ylbenzene
CID 173010088
ethane;ethylbenzene;methane;prop-1-ene;N-propylpropan-2-imine
CID 142074696
benzene;phenol;prop-1-ene
CID 174830652
methane;propane;prop-1-en-2-ylbenzene
CID 145329923
ethylbenzene;2-methylbut-2-ene
CID 145143829
benzoyl benzenecarboperoxoate;prop-1-ene
CID 163525367
1-ethenyl-4-ethylbenzene;prop-1-en-2-ylbenzene
CID 159036970

Frequently Asked Questions

What is the IUPAC name of [(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene?
The IUPAC name of [(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene (CID 143525147) is [(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene.
What is the SMILES notation for [(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene?
The canonical SMILES for [(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene is C=CC.CCC1=CC(=C(c2ccccc2)c2ccccc2)C=C1.
What is the InChIKey of [(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene?
The InChIKey is HJHMCAPJRDJZNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18.C3H6/c1-2-16-13-14-19(15-16)20(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-3-2/h3-15H,2H2,1H3;3H,1H2,2H3.
What are the key properties of [(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene?
[(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene has a molecular weight of 300.45 g/mol, XLogP of 6.59, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-ethylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene;prop-1-ene is sourced from PubChem (CID 143525147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).