[(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol

C21H26N2O — CID 92524928

IUPAC[(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol
SMILESCN(C)/N=C1/CCCC[C@@H]1C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H26N2O/c1-23(2)22-20-16-10-9-15-19(20)21(24,17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3-8,11-14,19,24H,9-10,15-16H2,1-2H3/b22-20-/t19-/m0/s1
InChIKeyGHABZPGWMZILRE-MMDUXOIOSA-N
MW322.45 g/mol
LogP4.03
Rot. Bonds4

About [(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol

[(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol (PubChem CID 92524928) has the molecular formula C21H26N2O and a molecular weight of 322.45 g/mol. Its IUPAC name is [(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol.

Molecular Properties

Compound Name[(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol
PubChem CID92524928
Molecular FormulaC21H26N2O
Molecular Weight322.45 g/mol
Exact Mass322.20
IUPAC Name[(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol
SMILESCN(C)/N=C1/CCCC[C@@H]1C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H26N2O/c1-23(2)22-20-16-10-9-15-19(20)21(24,17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3-8,11-14,19,24H,9-10,15-16H2,1-2H3/b22-20-/t19-/m0/s1
InChIKeyGHABZPGWMZILRE-MMDUXOIOSA-N
XLogP4.03
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[2-(dimethylamino)cyclohexyl]-diphenylmethanol
CID 11971775
(2S)-2-[(1S)-1-hydroxy-1-phenylpropyl]cyclohexan-1-one
CID 102452040
2-[[(1S,2S)-2-[(2-hydroxy-2,2-diphenylethyl)-methylamino]cyclohexyl]-methylamino]-1,1-diphenylethanol
CID 101490678
(1R)-1-cyclopentyl-1-phenylethane-1,2-diol;ethane
CID 142373793
(1R)-1-cyclopentyl-1-phenylethanol;sulfane
CID 158992083
cyclopropyl-phenyl-(2,3,4,5-tetrahydropyridin-6-ylamino)methanol
CID 54048321
[2-methoxy-1-(2-methylidenecyclohexyl)-1-nitrosoethyl]benzene
CID 163415997
1-(oxan-2-yl)-1-phenylethanol
CID 102596007
(S)-cyclohexyl-[(4S,5S)-5-[(S)-cyclohexyl-hydroxy-phenylmethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-phenylmethanol
CID 101412837
(NZ)-N-[(2S)-2-phenylcyclohexylidene]hydroxylamine
CID 92524008
(NE)-N-[(2R)-2-phenylcyclohexylidene]hydroxylamine
CID 98298121
[(2S)-1-methylaziridin-2-yl]-diphenylmethanol
CID 101268186

Frequently Asked Questions

What is the IUPAC name of [(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol?
The IUPAC name of [(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol (CID 92524928) is [(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol.
What is the SMILES notation for [(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol?
The canonical SMILES for [(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol is CN(C)/N=C1/CCCC[C@@H]1C(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of [(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol?
The InChIKey is GHABZPGWMZILRE-MMDUXOIOSA-N. The full InChI is InChI=1S/C21H26N2O/c1-23(2)22-20-16-10-9-15-19(20)21(24,17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3-8,11-14,19,24H,9-10,15-16H2,1-2H3/b22-20-/t19-/m0/s1.
What are the key properties of [(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol?
[(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol has a molecular weight of 322.45 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol is sourced from PubChem (CID 92524928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).