CID 135081440

C22H19 — CID 135081440

IUPAC—
SMILESC=C[CH]C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H19/c1-2-18-22(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h2-18H,1H2
InChIKeyWTGMUIMGFQZULH-UHFFFAOYSA-N
MW283.39 g/mol
LogP5.41
Rot. Bonds5

About CID 135081440

CID 135081440 (PubChem CID 135081440) has the molecular formula C22H19 and a molecular weight of 283.39 g/mol.

Molecular Properties

Compound NameCID 135081440
PubChem CID135081440
Molecular FormulaC22H19
Molecular Weight283.39 g/mol
Exact Mass283.15
IUPAC Name—
SMILESC=C[CH]C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H19/c1-2-18-22(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h2-18H,1H2
InChIKeyWTGMUIMGFQZULH-UHFFFAOYSA-N
XLogP5.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.39
LogP ≤ 55.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

(E)-4,4,4-triphenylbut-2-enethial
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bis(1,1-diphenylprop-2-enyl)phosphane
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CID 155685834
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CID 173024270
1-(1-amino-1-phenylprop-2-enoxy)-1-phenylprop-2-en-1-amine
CID 67646967
[ethenylsulfonyl(diphenyl)methyl]benzene
CID 18788028
1-phenylbut-3-ene-1,1-diol
CID 134892936
2,4-dimethyl-3-phenylhex-5-en-3-amine
CID 10679669
(1-ethenyl-1-phenylprop-2-enoxy)benzene
CID 67928175
1,1-diphenylpent-4-en-1-amine
CID 102295553

Frequently Asked Questions

What is the IUPAC name of CID 135081440?
The IUPAC name of CID 135081440 (CID 135081440) is not available.
What is the SMILES notation for CID 135081440?
The canonical SMILES for CID 135081440 is C=C[CH]C(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 135081440?
The InChIKey is WTGMUIMGFQZULH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19/c1-2-18-22(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h2-18H,1H2.
What are the key properties of CID 135081440?
CID 135081440 has a molecular weight of 283.39 g/mol, XLogP of 5.41, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 135081440 is sourced from PubChem (CID 135081440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).