(1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol

C14H20N2O — CID 134930482

IUPAC(1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol
SMILESC=CCC(C)(O)/C(=N/N(C)C)c1ccccc1
InChIInChI=1S/C14H20N2O/c1-5-11-14(2,17)13(15-16(3)4)12-9-7-6-8-10-12/h5-10,17H,1,11H2,2-4H3/b15-13+
InChIKeyMKFACTOXNJWMDI-FYWRMAATSA-N
MW232.33 g/mol
LogP2.28
Rot. Bonds5

About (1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol

(1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol (PubChem CID 134930482) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is (1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol.

Molecular Properties

Compound Name(1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol
PubChem CID134930482
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name(1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol
SMILESC=CCC(C)(O)/C(=N/N(C)C)c1ccccc1
InChIInChI=1S/C14H20N2O/c1-5-11-14(2,17)13(15-16(3)4)12-9-7-6-8-10-12/h5-10,17H,1,11H2,2-4H3/b15-13+
InChIKeyMKFACTOXNJWMDI-FYWRMAATSA-N
XLogP2.28
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[C-(2-fluorophenyl)-N-methylcarbonimidoyl]cyclopentan-1-ol
CID 13771616
1-[Imino(phenyl)methyl]cyclopentan-1-ol
CID 15724674
1-Imino-2-methyl-1-phenylpropan-2-ol
CID 134923936
3-(4-Fluorophenyl)-3-methyliminoprop-1-en-2-ol
CID 145145916
3-Ethylimino-3-(4-fluorophenyl)prop-1-en-2-ol
CID 145146157
1-[C-(3-fluorophenyl)-N-methylcarbonimidoyl]cyclopentan-1-ol
CID 156538445
(Z)-1-(4-fluorophenyl)-4-methyl-1-methyliminopent-2-en-2-ol
CID 166783324
(1Z)-1-(dimethylhydrazinylidene)-1-phenylpent-4-en-2-ol
CID 14470973
(1Z)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol
CID 14470974
N-methyl-N-[(E)-(1-phenyl-2-prop-2-enoxypropylidene)amino]methanamine
CID 134895946
N-methyl-N-[(E)-(1-phenyl-2-prop-2-enoxyethylidene)amino]methanamine
CID 134896028
(1E)-1-(dimethylhydrazinylidene)-1-phenylpent-4-en-2-ol
CID 134992753

Frequently Asked Questions

What is the IUPAC name of (1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol?
The IUPAC name of (1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol (CID 134930482) is (1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol.
What is the SMILES notation for (1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol?
The canonical SMILES for (1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol is C=CCC(C)(O)/C(=N/N(C)C)c1ccccc1.
What is the InChIKey of (1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol?
The InChIKey is MKFACTOXNJWMDI-FYWRMAATSA-N. The full InChI is InChI=1S/C14H20N2O/c1-5-11-14(2,17)13(15-16(3)4)12-9-7-6-8-10-12/h5-10,17H,1,11H2,2-4H3/b15-13+.
What are the key properties of (1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol?
(1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol has a molecular weight of 232.33 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-1-(dimethylhydrazinylidene)-2-methyl-1-phenylpent-4-en-2-ol is sourced from PubChem (CID 134930482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).