N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide

C15H22N4O2 — CID 4221409

IUPACN-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide
SMILESCCN(CC)CC(=O)NN=Cc1ccc(NC(C)=O)cc1
InChIInChI=1S/C15H22N4O2/c1-4-19(5-2)11-15(21)18-16-10-13-6-8-14(9-7-13)17-12(3)20/h6-10H,4-5,11H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyFORYVBVZPOQHOK-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.44
Rot. Bonds7

About N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide

N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide (PubChem CID 4221409) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide.

Molecular Properties

Compound NameN-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide
PubChem CID4221409
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide
SMILESCCN(CC)CC(=O)NN=Cc1ccc(NC(C)=O)cc1
InChIInChI=1S/C15H22N4O2/c1-4-19(5-2)11-15(21)18-16-10-13-6-8-14(9-7-13)17-12(3)20/h6-10H,4-5,11H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyFORYVBVZPOQHOK-UHFFFAOYSA-N
XLogP1.44
TPSA73.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.44
H-Bond Donors ≤ 52
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

N-[(4-acetamidophenyl)methylideneamino]-2-hydroxyacetamide
CID 20982377
N-[(Z)-(4-acetamidophenyl)methylideneamino]-2-(azocan-1-yl)acetamide
CID 5407176
N-(4-acetamidophenyl)-N'-[(E)-[4-(dimethylamino)phenyl]methylideneamino]butanediamide
CID 171981399
2-[[2-(4-acetamidoanilino)-2-oxoethyl]-ethylamino]-N-(4-methylphenyl)acetamide
CID 8779968
methyl 4-[(Z)-[[2-[(4-acetamidophenyl)sulfonyl-methylamino]acetyl]hydrazinylidene]methyl]benzoate
CID 92513082
N-[(4-acetamidophenyl)methylideneamino]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 2396992
N-[4-[(octadecylcarbamothioylhydrazinylidene)methyl]phenyl]acetamide
CID 3893705
2-[(4-acetamidophenyl)sulfonyl-benzylamino]-N-[(E)-(4-hydroxyphenyl)methylideneamino]acetamide
CID 136742007
2-(diethylamino)-N-(4-methylphenyl)acetamide
CID 26382
1,3-bis[(E)-[4-(diethylamino)phenyl]methylideneamino]urea
CID 5335044
N-[(Z)-(4-acetamidophenyl)methylideneamino]-2-(3,4-dimethylphenoxy)acetamide
CID 9316133
N-[4-[(E)-[(4-hydroxyphenyl)carbamothioylhydrazinylidene]methyl]phenyl]acetamide
CID 143848723

Frequently Asked Questions

What is the IUPAC name of N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide?
The IUPAC name of N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide (CID 4221409) is N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide.
What is the SMILES notation for N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide?
The canonical SMILES for N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide is CCN(CC)CC(=O)NN=Cc1ccc(NC(C)=O)cc1.
What is the InChIKey of N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide?
The InChIKey is FORYVBVZPOQHOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-4-19(5-2)11-15(21)18-16-10-13-6-8-14(9-7-13)17-12(3)20/h6-10H,4-5,11H2,1-3H3,(H,17,20)(H,18,21).
What are the key properties of N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide?
N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide has a molecular weight of 290.37 g/mol, XLogP of 1.44, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-acetamidophenyl)methylideneamino]-2-(diethylamino)acetamide is sourced from PubChem (CID 4221409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).