N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide

C18H18ClN3O2 — CID 6375481

IUPACN-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide
SMILESC/C(=N/NC(=O)CNC(=O)Cc1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C18H18ClN3O2/c1-13(15-7-9-16(19)10-8-15)21-22-18(24)12-20-17(23)11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,20,23)(H,22,24)/b21-13-
InChIKeyYSKSFEBGYCZUDM-BKUYFWCQSA-N
MW343.81 g/mol
LogP2.54
Rot. Bonds6

About N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide

N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide (PubChem CID 6375481) has the molecular formula C18H18ClN3O2 and a molecular weight of 343.81 g/mol. Its IUPAC name is N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide
PubChem CID6375481
Molecular FormulaC18H18ClN3O2
Molecular Weight343.81 g/mol
Exact Mass343.11
IUPAC NameN-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide
SMILESC/C(=N/NC(=O)CNC(=O)Cc1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C18H18ClN3O2/c1-13(15-7-9-16(19)10-8-15)21-22-18(24)12-20-17(23)11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,20,23)(H,22,24)/b21-13-
InChIKeyYSKSFEBGYCZUDM-BKUYFWCQSA-N
XLogP2.54
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.81
LogP ≤ 52.54
H-Bond Donors ≤ 52
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

2-[2-[2-(4-chlorophenyl)acetyl]hydrazinyl]-N-cyclohexyl-2-oxoacetamide
CID 2084155
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N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-3-phenylpropanamide
CID 5904279
N-{2-[2-(1-benzylpropylidene)hydrazino]-2-oxoethyl}-2,4-dichlorobenzamide
CID 6529588
3-Chloro-N-[1-methyl-2-phenyl-eth-(E)-ylidene-hydrazinocarbonylmethyl]-benzamide
CID 9637909
2-[3-(4-chlorophenyl)-6-oxo-5,6-dihydropyridazin-1(4H)-yl]-N-(3-methylbutyl)acetamide
CID 16034816
N-[2-oxo-2-[(2E)-2-(1-phenylethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide
CID 5339599
N-(4-chlorobenzyl)-3-[(phenylacetyl)hydrazono]butanamide
CID 5815208
N-[1-Methyl-2-phenyl-eth-(Z)-ylidene-hydrazinocarbonylmethyl]-2,2-diphenyl-acetamide
CID 6370868
4-Chloro-N-(2-oxo-2-(2-(3-phenyl-2-propenylidene)hydrazino)ethyl)benzamide
CID 9596038
4-chloro-N-{2-oxo-2-[(2E)-2-(1-phenylbutylidene)hydrazino]ethyl}benzamide
CID 9599141
2-chloro-N-{2-[2-(1-methyl-3-phenyl-2-propenylidene)hydrazino]-2-oxoethyl}benzamide
CID 9653920

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide?
The IUPAC name of N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide (CID 6375481) is N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide?
The canonical SMILES for N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide is C/C(=N/NC(=O)CNC(=O)Cc1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide?
The InChIKey is YSKSFEBGYCZUDM-BKUYFWCQSA-N. The full InChI is InChI=1S/C18H18ClN3O2/c1-13(15-7-9-16(19)10-8-15)21-22-18(24)12-20-17(23)11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,20,23)(H,22,24)/b21-13-.
What are the key properties of N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide?
N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide has a molecular weight of 343.81 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-2-phenylacetamide is sourced from PubChem (CID 6375481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).