6-benzhydrylidenecyclohexa-2,4-dien-1-imine

C19H15N — CID 135032177

IUPAC6-benzhydrylidenecyclohexa-2,4-dien-1-imine
SMILES[H]/N=C1\C=CC=CC1=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H15N/c20-18-14-8-7-13-17(18)19(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14,20H/b20-18+
InChIKeyJMYDAHSAMHVWCF-CZIZESTLSA-N
MW257.34 g/mol
LogP4.63
Rot. Bonds2

About 6-benzhydrylidenecyclohexa-2,4-dien-1-imine

6-benzhydrylidenecyclohexa-2,4-dien-1-imine (PubChem CID 135032177) has the molecular formula C19H15N and a molecular weight of 257.34 g/mol. Its IUPAC name is 6-benzhydrylidenecyclohexa-2,4-dien-1-imine.

Molecular Properties

Compound Name6-benzhydrylidenecyclohexa-2,4-dien-1-imine
PubChem CID135032177
Molecular FormulaC19H15N
Molecular Weight257.34 g/mol
Exact Mass257.12
IUPAC Name6-benzhydrylidenecyclohexa-2,4-dien-1-imine
SMILES[H]/N=C1\C=CC=CC1=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H15N/c20-18-14-8-7-13-17(18)19(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14,20H/b20-18+
InChIKeyJMYDAHSAMHVWCF-CZIZESTLSA-N
XLogP4.63
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(6E)-6-(1-chloroprop-2-enylidene)cyclohexa-2,4-dien-1-imine
CID 89086016
(2E)-3-imino-2-(6-iminocyclohexa-2,4-dien-1-ylidene)propanoic acid
CID 118457112
2-N-benzylcyclohexa-3,5-diene-1,2-diimine
CID 149004713
sodium 2-[[(Z)-(3-chloro-6-iminocyclohexa-2,4-dien-1-ylidene)-phenylmethyl]-hydroxyamino]acetate
CID 132610159
4-benzhydrylidenecyclohexa-2,5-dien-1-imine
CID 67679531
(Z)-(6-iminocyclohexa-2,4-dien-1-ylidene)-[2-(trimethylazaniumyl)ethoxy]methanolate;hydroiodide
CID 138398554
[(2-ditert-butylphosphorylcyclopenta-2,4-dien-1-ylidene)-phenylmethyl]benzene
CID 15423949
(1Z)-1-cyclohepta-1,3,5-trien-1-yl-1-(6-iminocyclohexa-2,4-dien-1-ylidene)-N,N-dimethylmethanamine
CID 145302815
2-chloro-1-phenylethanimine
CID 13240605
[[2-(cyclopenta-1,4-dien-1-ylmethyl)cyclopenta-2,4-dien-1-ylidene]-phenylmethyl]benzene
CID 173171770
1,5-dibenzhydrylidenepentalene
CID 101439487
ethane;1-phenylethanimine
CID 91121262

Frequently Asked Questions

What is the IUPAC name of 6-benzhydrylidenecyclohexa-2,4-dien-1-imine?
The IUPAC name of 6-benzhydrylidenecyclohexa-2,4-dien-1-imine (CID 135032177) is 6-benzhydrylidenecyclohexa-2,4-dien-1-imine.
What is the SMILES notation for 6-benzhydrylidenecyclohexa-2,4-dien-1-imine?
The canonical SMILES for 6-benzhydrylidenecyclohexa-2,4-dien-1-imine is [H]/N=C1\C=CC=CC1=C(c1ccccc1)c1ccccc1.
What is the InChIKey of 6-benzhydrylidenecyclohexa-2,4-dien-1-imine?
The InChIKey is JMYDAHSAMHVWCF-CZIZESTLSA-N. The full InChI is InChI=1S/C19H15N/c20-18-14-8-7-13-17(18)19(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14,20H/b20-18+.
What are the key properties of 6-benzhydrylidenecyclohexa-2,4-dien-1-imine?
6-benzhydrylidenecyclohexa-2,4-dien-1-imine has a molecular weight of 257.34 g/mol, XLogP of 4.63, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-benzhydrylidenecyclohexa-2,4-dien-1-imine is sourced from PubChem (CID 135032177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).