N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide

C19H23N3O3S — CID 1284363

IUPACN-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide
SMILESCCN(CC)c1ccc(/C=N/c2ccc(S(=O)(=O)NC(C)=O)cc2)cc1
InChIInChI=1S/C19H23N3O3S/c1-4-22(5-2)18-10-6-16(7-11-18)14-20-17-8-12-19(13-9-17)26(24,25)21-15(3)23/h6-14H,4-5H2,1-3H3,(H,21,23)/b20-14+
InChIKeyFUAQZRRTGYKGTR-XSFVSMFZSA-N
MW373.48 g/mol
LogP3.11
Rot. Bonds7

About N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide

N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide (PubChem CID 1284363) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide.

Molecular Properties

Compound NameN-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide
PubChem CID1284363
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC NameN-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide
SMILESCCN(CC)c1ccc(/C=N/c2ccc(S(=O)(=O)NC(C)=O)cc2)cc1
InChIInChI=1S/C19H23N3O3S/c1-4-22(5-2)18-10-6-16(7-11-18)14-20-17-8-12-19(13-9-17)26(24,25)21-15(3)23/h6-14H,4-5H2,1-3H3,(H,21,23)/b20-14+
InChIKeyFUAQZRRTGYKGTR-XSFVSMFZSA-N
XLogP3.11
TPSA78.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-[4-[(4-cyanophenyl)methylideneamino]phenyl]sulfonylacetamide
CID 932395
2-[[4-[[4-(diethylamino)phenyl]methylideneamino]benzoyl]amino]acetic acid
CID 7207787
N-[(E)-[4-(diethylamino)phenyl]methylideneamino]benzenesulfonamide
CID 5335146
N-[4-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfanylphenyl]hydroxylamine
CID 89343522
N-[4-(diethylsulfamoyl)phenyl]sulfonylacetamide
CID 154139337
4-[[4-(diethylamino)phenyl]methylideneamino]-N-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)benzamide
CID 3719233
4-[[4-(diethylamino)phenyl]iminomethyl]-2-nitrophenol
CID 135581129
N-[4-[[4-(diethylamino)-2-hydroxyphenyl]methylideneamino]phenyl]acetamide
CID 738975
1,3-bis[(E)-[4-(diethylamino)phenyl]methylideneamino]urea
CID 5335044
1-cyclohexyl-3-[4-[[4-(diethylamino)phenyl]diazenyl]phenyl]sulfonylurea
CID 78060683
[(E)-[4-(diethylamino)phenyl]methylideneamino] acetate
CID 87078724
N-(4-aminophenyl)sulfonylacetamide;N,N-diethylethanamine
CID 175178486

Frequently Asked Questions

What is the IUPAC name of N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide?
The IUPAC name of N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide (CID 1284363) is N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide.
What is the SMILES notation for N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide?
The canonical SMILES for N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide is CCN(CC)c1ccc(/C=N/c2ccc(S(=O)(=O)NC(C)=O)cc2)cc1.
What is the InChIKey of N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide?
The InChIKey is FUAQZRRTGYKGTR-XSFVSMFZSA-N. The full InChI is InChI=1S/C19H23N3O3S/c1-4-22(5-2)18-10-6-16(7-11-18)14-20-17-8-12-19(13-9-17)26(24,25)21-15(3)23/h6-14H,4-5H2,1-3H3,(H,21,23)/b20-14+.
What are the key properties of N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide?
N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide has a molecular weight of 373.48 g/mol, XLogP of 3.11, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[4-(diethylamino)phenyl]methylideneamino]phenyl]sulfonylacetamide is sourced from PubChem (CID 1284363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).