(2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide

C11H15N3O — CID 177401018

IUPAC(2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide
SMILESCc1ccc(N/N=C/C(=O)N(C)C)cc1
InChIInChI=1S/C11H15N3O/c1-9-4-6-10(7-5-9)13-12-8-11(15)14(2)3/h4-8,13H,1-3H3/b12-8+
InChIKeyQSWYLXHJFHUGCB-XYOKQWHBSA-N
MW205.26 g/mol
LogP1.48
Rot. Bonds3

About (2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide

(2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide (PubChem CID 177401018) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is (2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide.

Molecular Properties

Compound Name(2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide
PubChem CID177401018
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name(2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide
SMILESCc1ccc(N/N=C/C(=O)N(C)C)cc1
InChIInChI=1S/C11H15N3O/c1-9-4-6-10(7-5-9)13-12-8-11(15)14(2)3/h4-8,13H,1-3H3/b12-8+
InChIKeyQSWYLXHJFHUGCB-XYOKQWHBSA-N
XLogP1.48
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.48
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

ethyl 2,3-bis[(4-methylphenyl)hydrazinylidene]propanoate
CID 71428518
2-(phenylhydrazinylidene)-1-[4-[2-(phenylhydrazinylidene)acetyl]phenyl]ethanone
CID 2749285
methyl 2-[[(4-methylphenyl)hydrazinylidene]methylsulfanyl]acetate
CID 71411757
2-[[(4-methylphenyl)hydrazinylidene]methyl]benzoic acid
CID 110840968
methyl 3-[(4-methylphenyl)hydrazinylidene]-2-oxobutanoate
CID 88827249
1-(4-methylphenyl)-3-[(4-methylphenyl)carbamoylamino]urea
CID 54178073
(2E,4E)-N,N-dimethyl-5-(4-methylphenyl)penta-2,4-dienamide
CID 139551714
N-(4-methylphenyl)acetamide
CID 7684
ethane;ethyl (2E)-2-(phenylhydrazinylidene)acetate
CID 90967313
1-[3-(dimethylamino)propyl]-3-(4-methylphenyl)urea
CID 47103513
1-[ethyl(methyl)amino]-3-(4-methylphenyl)urea
CID 90799043
N-[bis(4-methylphenyl)methylideneamino]-4-methylaniline
CID 59951194

Frequently Asked Questions

What is the IUPAC name of (2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide?
The IUPAC name of (2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide (CID 177401018) is (2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide.
What is the SMILES notation for (2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide?
The canonical SMILES for (2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide is Cc1ccc(N/N=C/C(=O)N(C)C)cc1.
What is the InChIKey of (2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide?
The InChIKey is QSWYLXHJFHUGCB-XYOKQWHBSA-N. The full InChI is InChI=1S/C11H15N3O/c1-9-4-6-10(7-5-9)13-12-8-11(15)14(2)3/h4-8,13H,1-3H3/b12-8+.
What are the key properties of (2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide?
(2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide has a molecular weight of 205.26 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-N,N-dimethyl-2-[(4-methylphenyl)hydrazinylidene]acetamide is sourced from PubChem (CID 177401018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).