2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide

C20H17N3O4 — CID 3117709

IUPAC2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide
SMILESCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3ccccc23)cc1
InChIInChI=1S/C20H17N3O4/c1-27-15-11-9-14(10-12-15)18(24)22-23-20(26)19(25)21-17-8-4-6-13-5-2-3-7-16(13)17/h2-12H,1H3,(H,21,25)(H,22,24)(H,23,26)
InChIKeyOWRLHBDMTGHVLT-UHFFFAOYSA-N
MW363.37 g/mol
LogP2.25
Rot. Bonds3

About 2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide

2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide (PubChem CID 3117709) has the molecular formula C20H17N3O4 and a molecular weight of 363.37 g/mol. Its IUPAC name is 2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide.

Molecular Properties

Compound Name2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide
PubChem CID3117709
Molecular FormulaC20H17N3O4
Molecular Weight363.37 g/mol
Exact Mass363.12
IUPAC Name2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide
SMILESCOc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3ccccc23)cc1
InChIInChI=1S/C20H17N3O4/c1-27-15-11-9-14(10-12-15)18(24)22-23-20(26)19(25)21-17-8-4-6-13-5-2-3-7-16(13)17/h2-12H,1H3,(H,21,25)(H,22,24)(H,23,26)
InChIKeyOWRLHBDMTGHVLT-UHFFFAOYSA-N
XLogP2.25
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.37
LogP ≤ 52.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[(E)-1-(4-methoxyphenyl)-3-(naphthalen-1-ylamino)-3-oxoprop-1-en-2-yl]benzamide
CID 1218137
N-[(Z)-1-(4-methoxyphenyl)-3-(naphthalen-1-ylamino)-3-oxoprop-1-en-2-yl]benzamide
CID 2189607
1-N',4-N'-bis(4-methoxybenzoyl)butanedihydrazide
CID 3140699
1-[[2-(4-methoxyphenoxy)acetyl]amino]-3-naphthalen-1-ylurea
CID 17490110
N-(2-hydroxyethyl)-2-[2-(4-methoxybenzoyl)hydrazinyl]-2-oxoacetamide
CID 3117716
1-(2-chlorophenyl)-3-[(4-methoxybenzoyl)amino]urea
CID 4825619
2-amino-4-methoxy-N-naphthalen-1-ylbenzamide
CID 82546437
N-[4-[[(4-methoxybenzoyl)amino]carbamoyl]phenyl]benzamide
CID 1246678
2-N',6-N'-bis(4-methoxybenzoyl)pyridine-2,6-dicarbohydrazide
CID 43070155
3-(4-methoxyphenyl)-N-naphthalen-1-ylprop-2-enamide
CID 668259
4-heptoxy-N-naphthalen-1-ylbenzamide
CID 4950571
N-(naphthalen-1-ylcarbamothioyl)-4-phenylmethoxybenzamide
CID 22775968

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide?
The IUPAC name of 2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide (CID 3117709) is 2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide.
What is the SMILES notation for 2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide?
The canonical SMILES for 2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide is COc1ccc(C(=O)NNC(=O)C(=O)Nc2cccc3ccccc23)cc1.
What is the InChIKey of 2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide?
The InChIKey is OWRLHBDMTGHVLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O4/c1-27-15-11-9-14(10-12-15)18(24)22-23-20(26)19(25)21-17-8-4-6-13-5-2-3-7-16(13)17/h2-12H,1H3,(H,21,25)(H,22,24)(H,23,26).
What are the key properties of 2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide?
2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide has a molecular weight of 363.37 g/mol, XLogP of 2.25, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methoxybenzoyl)hydrazinyl]-N-naphthalen-1-yl-2-oxoacetamide is sourced from PubChem (CID 3117709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).