[(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene

C25H22 — CID 162399888

IUPAC[(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene
SMILESC(=C1\CCCC1=C(c1ccccc1)c1ccccc1)\c1ccccc1
InChIInChI=1S/C25H22/c1-4-11-20(12-5-1)19-23-17-10-18-24(23)25(21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-9,11-16,19H,10,17-18H2/b23-19+
InChIKeyCSXOYZCSRXZUCP-FCDQGJHFSA-N
MW322.45 g/mol
LogP6.76
Rot. Bonds3

About [(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene

[(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene (PubChem CID 162399888) has the molecular formula C25H22 and a molecular weight of 322.45 g/mol. Its IUPAC name is [(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene.

Molecular Properties

Compound Name[(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene
PubChem CID162399888
Molecular FormulaC25H22
Molecular Weight322.45 g/mol
Exact Mass322.17
IUPAC Name[(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene
SMILESC(=C1\CCCC1=C(c1ccccc1)c1ccccc1)\c1ccccc1
InChIInChI=1S/C25H22/c1-4-11-20(12-5-1)19-23-17-10-18-24(23)25(21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-9,11-16,19H,10,17-18H2/b23-19+
InChIKeyCSXOYZCSRXZUCP-FCDQGJHFSA-N
XLogP6.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.45
LogP ≤ 56.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[(E)-[(2E)-2-[(2E)-2-benzylidenecyclopentylidene]cyclopentylidene]methyl]benzene
CID 102353604
(6E)-2,6-dibenzylidenecyclohexan-1-one
CID 1240877
(8E)-8-benzylidene-4-phenyl-6,7-dihydro-5H-quinazolin-2-amine
CID 13170787
(2E,8E)-2,8-dibenzylidenecyclooctan-1-one
CID 6439695
[(1Z)-1-[(2E)-2-ethylidenecyclopentylidene]ethyl]benzene
CID 135038215
[(E)-[(2E)-2-benzylidenecyclohexylidene]methyl]-trimethylsilane
CID 10539037
(7E)-7-benzylidene-3-(trifluoromethyl)-5,6-dihydro-4H-2,1-benzoxazole
CID 12965268
methyl (2E)-2-[(2Z)-2-benzylidenecyclohexylidene]acetate
CID 101066852
2-benzylidenecyclobutan-1-one
CID 73042587
(6Z)-6-benzylidene-2,2-bis(hydroxymethyl)cyclohexan-1-one
CID 117060458
(2E,6E)-2-benzylidene-6-[[4-(dimethylamino)phenyl]methylidene]cyclohexan-1-one
CID 2313555
(NE)-N-[(2E,6S)-2-benzylidene-6-methylcyclohexylidene]hydroxylamine
CID 5410936

Frequently Asked Questions

What is the IUPAC name of [(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene?
The IUPAC name of [(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene (CID 162399888) is [(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene.
What is the SMILES notation for [(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene?
The canonical SMILES for [(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene is C(=C1\CCCC1=C(c1ccccc1)c1ccccc1)\c1ccccc1.
What is the InChIKey of [(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene?
The InChIKey is CSXOYZCSRXZUCP-FCDQGJHFSA-N. The full InChI is InChI=1S/C25H22/c1-4-11-20(12-5-1)19-23-17-10-18-24(23)25(21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-9,11-16,19H,10,17-18H2/b23-19+.
What are the key properties of [(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene?
[(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene has a molecular weight of 322.45 g/mol, XLogP of 6.76, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-(2-benzhydrylidenecyclopentylidene)methyl]benzene is sourced from PubChem (CID 162399888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).