4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide

C24H25N3O5S — CID 55495347

IUPAC4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide
SMILESCc1ccc(C(=O)NNC(=O)Cc2cccc3ccccc23)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C24H25N3O5S/c1-17-9-10-20(15-22(17)33(30,31)27-11-13-32-14-12-27)24(29)26-25-23(28)16-19-7-4-6-18-5-2-3-8-21(18)19/h2-10,15H,11-14,16H2,1H3,(H,25,28)(H,26,29)
InChIKeyJUGNNIBNVNMPBR-UHFFFAOYSA-N
MW467.55 g/mol
LogP2.17
Rot. Bonds5

About 4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide

4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide (PubChem CID 55495347) has the molecular formula C24H25N3O5S and a molecular weight of 467.55 g/mol. Its IUPAC name is 4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide.

Molecular Properties

Compound Name4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide
PubChem CID55495347
Molecular FormulaC24H25N3O5S
Molecular Weight467.55 g/mol
Exact Mass467.15
IUPAC Name4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide
SMILESCc1ccc(C(=O)NNC(=O)Cc2cccc3ccccc23)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C24H25N3O5S/c1-17-9-10-20(15-22(17)33(30,31)27-11-13-32-14-12-27)24(29)26-25-23(28)16-19-7-4-6-18-5-2-3-8-21(18)19/h2-10,15H,11-14,16H2,1H3,(H,25,28)(H,26,29)
InChIKeyJUGNNIBNVNMPBR-UHFFFAOYSA-N
XLogP2.17
TPSA104.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.55
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-amino-2-oxoethyl)phenyl]-4-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 55670048
N-(2-benzylphenyl)-4-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 5161786
N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)naphthalene-2-carboxamide
CID 7929134
N-(2-hydroxyphenyl)-4-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 23904636
N-(2,2-diphenylethyl)-4-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 26795823
4-methyl-3-morpholin-4-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide
CID 2337108
4-methyl-N-[2-(methylamino)ethyl]-3-morpholin-4-ylsulfonylbenzamide;hydrochloride
CID 119503940
4-methyl-3-morpholin-4-ylsulfonyl-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 2940828
N-(2-fluorophenyl)-4-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 2710293
N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)-2-naphthalen-1-ylacetamide
CID 18158882
N-[3-(methoxymethyl)phenyl]-4-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 32638427
N-[3-(aminomethyl)pentan-3-yl]-4-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 119571738

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide?
The IUPAC name of 4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide (CID 55495347) is 4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide.
What is the SMILES notation for 4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide?
The canonical SMILES for 4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide is Cc1ccc(C(=O)NNC(=O)Cc2cccc3ccccc23)cc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of 4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide?
The InChIKey is JUGNNIBNVNMPBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O5S/c1-17-9-10-20(15-22(17)33(30,31)27-11-13-32-14-12-27)24(29)26-25-23(28)16-19-7-4-6-18-5-2-3-8-21(18)19/h2-10,15H,11-14,16H2,1H3,(H,25,28)(H,26,29).
What are the key properties of 4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide?
4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide has a molecular weight of 467.55 g/mol, XLogP of 2.17, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-morpholin-4-ylsulfonyl-N'-(2-naphthalen-1-ylacetyl)benzohydrazide is sourced from PubChem (CID 55495347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).