1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene

C25H24 — CID 59268378

IUPAC1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene
SMILESC=C(C)c1cccc(CC(=C)C(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C25H24/c1-19(2)24-16-10-11-21(18-24)17-20(3)25(22-12-6-4-7-13-22)23-14-8-5-9-15-23/h4-16,18,25H,1,3,17H2,2H3
InChIKeyNADKOKAESAJATA-UHFFFAOYSA-N
MW324.47 g/mol
LogP6.65
Rot. Bonds6

About 1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene

1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene (PubChem CID 59268378) has the molecular formula C25H24 and a molecular weight of 324.47 g/mol. Its IUPAC name is 1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene.

Molecular Properties

Compound Name1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene
PubChem CID59268378
Molecular FormulaC25H24
Molecular Weight324.47 g/mol
Exact Mass324.19
IUPAC Name1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene
SMILESC=C(C)c1cccc(CC(=C)C(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C25H24/c1-19(2)24-16-10-11-21(18-24)17-20(3)25(22-12-6-4-7-13-22)23-14-8-5-9-15-23/h4-16,18,25H,1,3,17H2,2H3
InChIKeyNADKOKAESAJATA-UHFFFAOYSA-N
XLogP6.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.47
LogP ≤ 56.65
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

1-ethyl-3-prop-1-en-2-ylbenzene
CID 14178225
1-prop-1-en-2-yl-3-propylbenzene
CID 22486655
1-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamic acid
CID 70165401
CID 23527697
CID 23527697
benzylbenzene;1-[(Z)-prop-1-enyl]-3-prop-1-en-2-ylbenzene
CID 142453326
(E)-3-(3-prop-1-en-2-ylphenyl)prop-1-en-1-amine
CID 134297759
prop-1-en-2-ylbenzene;silane
CID 174724970
ethane;tris(prop-1-en-2-ylbenzene)
CID 161299444
2,4-dichloro-1-[(3-prop-1-en-2-ylphenyl)methyl]benzene
CID 155153874
1,3-diphenyl-5-(3-prop-1-en-2-ylphenyl)benzene
CID 145452335
2-phenyl-1-(3-propan-2-ylphenyl)ethanone
CID 146007200
1-propan-2-yl-2-prop-1-en-2-ylbenzene;1-propan-2-yl-3-prop-1-en-2-ylbenzene
CID 173398854

Frequently Asked Questions

What is the IUPAC name of 1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene?
The IUPAC name of 1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene (CID 59268378) is 1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene.
What is the SMILES notation for 1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene?
The canonical SMILES for 1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene is C=C(C)c1cccc(CC(=C)C(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of 1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene?
The InChIKey is NADKOKAESAJATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24/c1-19(2)24-16-10-11-21(18-24)17-20(3)25(22-12-6-4-7-13-22)23-14-8-5-9-15-23/h4-16,18,25H,1,3,17H2,2H3.
What are the key properties of 1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene?
1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene has a molecular weight of 324.47 g/mol, XLogP of 6.65, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-benzhydrylprop-2-enyl)-3-prop-1-en-2-ylbenzene is sourced from PubChem (CID 59268378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).