N-[4-[acetyl(chloro)amino]phenyl]acetamide

C10H11ClN2O2 — CID 58018072

IUPACN-[4-[acetyl(chloro)amino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(N(Cl)C(C)=O)cc1
InChIInChI=1S/C10H11ClN2O2/c1-7(14)12-9-3-5-10(6-4-9)13(11)8(2)15/h3-6H,1-2H3,(H,12,14)
InChIKeyGKMHJIRGEMHOJJ-UHFFFAOYSA-N
MW226.66 g/mol
LogP2.15
Rot. Bonds2

About N-[4-[acetyl(chloro)amino]phenyl]acetamide

N-[4-[acetyl(chloro)amino]phenyl]acetamide (PubChem CID 58018072) has the molecular formula C10H11ClN2O2 and a molecular weight of 226.66 g/mol. Its IUPAC name is N-[4-[acetyl(chloro)amino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[acetyl(chloro)amino]phenyl]acetamide
PubChem CID58018072
Molecular FormulaC10H11ClN2O2
Molecular Weight226.66 g/mol
Exact Mass226.05
IUPAC NameN-[4-[acetyl(chloro)amino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(N(Cl)C(C)=O)cc1
InChIInChI=1S/C10H11ClN2O2/c1-7(14)12-9-3-5-10(6-4-9)13(11)8(2)15/h3-6H,1-2H3,(H,12,14)
InChIKeyGKMHJIRGEMHOJJ-UHFFFAOYSA-N
XLogP2.15
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.66
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-chloro-N-[4-(chloroamino)phenyl]acetamide
CID 174326232
N-[4-[bis(2-chloroethyl)amino]phenyl]acetamide
CID 14613
N-[4-[methyl(methylsulfonyl)amino]phenyl]acetamide
CID 977789
N-(4-methylphenyl)acetamide
CID 7684
4-acetamidobenzoyl chloride
CID 7010341
N-(4-acetamidophenyl)-4-(dimethylamino)benzamide
CID 669679
N-(4-acetamidophenyl)-N'-[4-(diethylamino)phenyl]propanediamide
CID 108956266
N-(4-iodophenyl)acetamide
CID 12147
N-(4-hydroxyphenyl)acetamide;iron
CID 69304461
N-(4-hydroxyphenyl)acetamide;dihydrate
CID 140999210
N-[4-(4-chloroanilino)phenyl]acetamide
CID 71397904
N-(4-acetamidophenyl)-2-[N-acetyl-4-(dimethylamino)anilino]acetamide
CID 113176781

Frequently Asked Questions

What is the IUPAC name of N-[4-[acetyl(chloro)amino]phenyl]acetamide?
The IUPAC name of N-[4-[acetyl(chloro)amino]phenyl]acetamide (CID 58018072) is N-[4-[acetyl(chloro)amino]phenyl]acetamide.
What is the SMILES notation for N-[4-[acetyl(chloro)amino]phenyl]acetamide?
The canonical SMILES for N-[4-[acetyl(chloro)amino]phenyl]acetamide is CC(=O)Nc1ccc(N(Cl)C(C)=O)cc1.
What is the InChIKey of N-[4-[acetyl(chloro)amino]phenyl]acetamide?
The InChIKey is GKMHJIRGEMHOJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O2/c1-7(14)12-9-3-5-10(6-4-9)13(11)8(2)15/h3-6H,1-2H3,(H,12,14).
What are the key properties of N-[4-[acetyl(chloro)amino]phenyl]acetamide?
N-[4-[acetyl(chloro)amino]phenyl]acetamide has a molecular weight of 226.66 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[acetyl(chloro)amino]phenyl]acetamide is sourced from PubChem (CID 58018072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).