N-(5-acetamido-2,4-dianilinophenyl)acetamide

C22H22N4O2 — CID 23026476

IUPACN-(5-acetamido-2,4-dianilinophenyl)acetamide
SMILESCC(=O)Nc1cc(NC(C)=O)c(Nc2ccccc2)cc1Nc1ccccc1
InChIInChI=1S/C22H22N4O2/c1-15(27)23-19-13-20(24-16(2)28)22(26-18-11-7-4-8-12-18)14-21(19)25-17-9-5-3-6-10-17/h3-14,25-26H,1-2H3,(H,23,27)(H,24,28)
InChIKeyIAXWHOZKXNKJNU-UHFFFAOYSA-N
MW374.44 g/mol
LogP5.09
Rot. Bonds6

About N-(5-acetamido-2,4-dianilinophenyl)acetamide

N-(5-acetamido-2,4-dianilinophenyl)acetamide (PubChem CID 23026476) has the molecular formula C22H22N4O2 and a molecular weight of 374.44 g/mol. Its IUPAC name is N-(5-acetamido-2,4-dianilinophenyl)acetamide.

Molecular Properties

Compound NameN-(5-acetamido-2,4-dianilinophenyl)acetamide
PubChem CID23026476
Molecular FormulaC22H22N4O2
Molecular Weight374.44 g/mol
Exact Mass374.17
IUPAC NameN-(5-acetamido-2,4-dianilinophenyl)acetamide
SMILESCC(=O)Nc1cc(NC(C)=O)c(Nc2ccccc2)cc1Nc1ccccc1
InChIInChI=1S/C22H22N4O2/c1-15(27)23-19-13-20(24-16(2)28)22(26-18-11-7-4-8-12-18)14-21(19)25-17-9-5-3-6-10-17/h3-14,25-26H,1-2H3,(H,23,27)(H,24,28)
InChIKeyIAXWHOZKXNKJNU-UHFFFAOYSA-N
XLogP5.09
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.44
LogP ≤ 55.09
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

methyl N-[2,4-dianilino-5-(methoxycarbonylamino)phenyl]carbamate
CID 23026427
N-(3-acetamidoazulen-1-yl)acetamide
CID 86151929
N-(4-anilino-9,10-dioxoanthracen-1-yl)acetamide
CID 5166275
cobalt;N-phenylacetamide
CID 158689050
N-[2-(4-methylanilino)phenyl]acetamide
CID 21106134
N-[2-(4-benzoylanilino)phenyl]acetamide
CID 18358189
N-[2-(phenylcarbamoylamino)phenyl]acetamide
CID 113093680
N-(4-anilino-2,6-dimethylphenyl)acetamide
CID 69353089
N-(3-acetamido-4-methylphenyl)-2-anilinobenzamide
CID 47058047
acetyl bromide;N-phenylacetamide
CID 175285562
N-phenylacetamide;toluene
CID 175205531
deuteriomethane;ethane;N-phenylacetamide
CID 91156750

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2,4-dianilinophenyl)acetamide?
The IUPAC name of N-(5-acetamido-2,4-dianilinophenyl)acetamide (CID 23026476) is N-(5-acetamido-2,4-dianilinophenyl)acetamide.
What is the SMILES notation for N-(5-acetamido-2,4-dianilinophenyl)acetamide?
The canonical SMILES for N-(5-acetamido-2,4-dianilinophenyl)acetamide is CC(=O)Nc1cc(NC(C)=O)c(Nc2ccccc2)cc1Nc1ccccc1.
What is the InChIKey of N-(5-acetamido-2,4-dianilinophenyl)acetamide?
The InChIKey is IAXWHOZKXNKJNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O2/c1-15(27)23-19-13-20(24-16(2)28)22(26-18-11-7-4-8-12-18)14-21(19)25-17-9-5-3-6-10-17/h3-14,25-26H,1-2H3,(H,23,27)(H,24,28).
What are the key properties of N-(5-acetamido-2,4-dianilinophenyl)acetamide?
N-(5-acetamido-2,4-dianilinophenyl)acetamide has a molecular weight of 374.44 g/mol, XLogP of 5.09, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2,4-dianilinophenyl)acetamide is sourced from PubChem (CID 23026476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).