4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline

C16H19N3O — CID 21238347

IUPAC4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline
SMILESCOc1ccc(N/N=C/c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C16H19N3O/c1-19(2)15-8-4-13(5-9-15)12-17-18-14-6-10-16(20-3)11-7-14/h4-12,18H,1-3H3/b17-12+
InChIKeyCMHYUEVDELATTP-SFQUDFHCSA-N
MW269.35 g/mol
LogP3.21
Rot. Bonds5

About 4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline

4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline (PubChem CID 21238347) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline
PubChem CID21238347
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline
SMILESCOc1ccc(N/N=C/c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C16H19N3O/c1-19(2)15-8-4-13(5-9-15)12-17-18-14-6-10-16(20-3)11-7-14/h4-12,18H,1-3H3/b17-12+
InChIKeyCMHYUEVDELATTP-SFQUDFHCSA-N
XLogP3.21
TPSA36.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

4-[(Z)-[(4-fluorophenyl)hydrazinylidene]methyl]-N,N-dimethylaniline
CID 7955579
4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]phenol
CID 135510327
N-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-2-amine
CID 70584569
4-[(4-methoxyphenyl)methylideneamino]-N,N-dimethylaniline
CID 3748752
N-[[4-(dimethylamino)phenyl]methylideneamino]-4-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 5230090
4-[2-[(4-methoxyphenyl)methylidene]hydrazinyl]benzoate
CID 7824518
3,4-dichloro-N-[(4-methoxyphenyl)methylideneamino]aniline
CID 110840444
N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-3-(4-methoxyphenyl)-1,8-naphthyridin-2-amine
CID 10982194
2-[[4-amino-5-[(2E)-2-[[4-(dimethylamino)phenyl]methylidene]hydrazinyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)acetamide
CID 17049179
3-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]phenol
CID 110509088
N-[4-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]phenyl]-4-methylbenzenesulfonamide
CID 21237396
N-[(E)-(1-butylpyridin-1-ium-4-yl)methylideneamino]-4-methoxyaniline
CID 140695984

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline?
The IUPAC name of 4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline (CID 21238347) is 4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline?
The canonical SMILES for 4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline is COc1ccc(N/N=C/c2ccc(N(C)C)cc2)cc1.
What is the InChIKey of 4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline?
The InChIKey is CMHYUEVDELATTP-SFQUDFHCSA-N. The full InChI is InChI=1S/C16H19N3O/c1-19(2)15-8-4-13(5-9-15)12-17-18-14-6-10-16(20-3)11-7-14/h4-12,18H,1-3H3/b17-12+.
What are the key properties of 4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline?
4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline has a molecular weight of 269.35 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-[(4-methoxyphenyl)hydrazinylidene]methyl]-N,N-dimethylaniline is sourced from PubChem (CID 21238347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).