1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol

C16H22N2O — CID 134867566

IUPAC1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol
SMILESCN(C)/N=C/C1=C(C(C)(O)c2ccccc2)CCC1
InChIInChI=1S/C16H22N2O/c1-16(19,14-9-5-4-6-10-14)15-11-7-8-13(15)12-17-18(2)3/h4-6,9-10,12,19H,7-8,11H2,1-3H3/b17-12+
InChIKeyHULSJSSYSUSTDL-SFQUDFHCSA-N
MW258.37 g/mol
LogP2.92
Rot. Bonds4

About 1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol

1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol (PubChem CID 134867566) has the molecular formula C16H22N2O and a molecular weight of 258.37 g/mol. Its IUPAC name is 1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol.

Molecular Properties

Compound Name1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol
PubChem CID134867566
Molecular FormulaC16H22N2O
Molecular Weight258.37 g/mol
Exact Mass258.17
IUPAC Name1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol
SMILESCN(C)/N=C/C1=C(C(C)(O)c2ccccc2)CCC1
InChIInChI=1S/C16H22N2O/c1-16(19,14-9-5-4-6-10-14)15-11-7-8-13(15)12-17-18(2)3/h4-6,9-10,12,19H,7-8,11H2,1-3H3/b17-12+
InChIKeyHULSJSSYSUSTDL-SFQUDFHCSA-N
XLogP2.92
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.92
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'}

Analyze 1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4E)-4-(4-methylpiperazin-1-yl)imino-1,2-diphenylcyclopent-2-en-1-ol
CID 6260825
(1S,2R,3E)-3-(dimethylhydrazinylidene)-2-methyl-1-phenylpropan-1-ol
CID 134905620
(1S,2S,3E)-3-(dimethylhydrazinylidene)-2-methyl-1-phenylpropan-1-ol
CID 134975766
3-Ethylimino-1,1-diphenylpropan-1-ol
CID 162413586
(3E)-3-(dimethylhydrazinylidene)-1,1,1-trifluoro-2-phenylpropan-2-ol
CID 10658062
(3E)-2-benzyl-3-(dimethylhydrazinylidene)-1,1,1-trifluoropropan-2-ol
CID 10825220
(3E)-1,1,1-trifluoro-2-phenyl-3-pyrrolidin-1-yliminopropan-2-ol
CID 15893171
4-(4-Methylpiperazin-1-yl)imino-1,2-diphenylcyclopent-2-en-1-ol
CID 5061584
[(2Z)-2-(dimethylhydrazinylidene)cyclohexyl]-diphenylmethanol
CID 5950358
2,2-dimethyl-4-phenyl-3H-pyrrol-4-ol
CID 10035409
beta-Hydroxy-beta-phenylpropylideneamine
CID 20159059
2-[2-[3-[(Dimethylamino)methyl]cyclopenta-1,3-dien-1-yl]phenyl]propan-2-ol
CID 23015341

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol?
The IUPAC name of 1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol (CID 134867566) is 1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol.
What is the SMILES notation for 1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol?
The canonical SMILES for 1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol is CN(C)/N=C/C1=C(C(C)(O)c2ccccc2)CCC1.
What is the InChIKey of 1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol?
The InChIKey is HULSJSSYSUSTDL-SFQUDFHCSA-N. The full InChI is InChI=1S/C16H22N2O/c1-16(19,14-9-5-4-6-10-14)15-11-7-8-13(15)12-17-18(2)3/h4-6,9-10,12,19H,7-8,11H2,1-3H3/b17-12+.
What are the key properties of 1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol?
1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol has a molecular weight of 258.37 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(E)-(dimethylhydrazinylidene)methyl]cyclopenten-1-yl]-1-phenylethanol is sourced from PubChem (CID 134867566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).