N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide

C15H16ClN3O2 — CID 107733825

IUPACN-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide
SMILESCN(CC(=O)Nc1cc(N)ccc1Cl)c1cccc(O)c1
InChIInChI=1S/C15H16ClN3O2/c1-19(11-3-2-4-12(20)8-11)9-15(21)18-14-7-10(17)5-6-13(14)16/h2-8,20H,9,17H2,1H3,(H,18,21)
InChIKeyWXJKVOSCVLMULD-UHFFFAOYSA-N
MW305.77 g/mol
LogP2.70
Rot. Bonds4

About N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide

N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide (PubChem CID 107733825) has the molecular formula C15H16ClN3O2 and a molecular weight of 305.77 g/mol. Its IUPAC name is N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide.

Molecular Properties

Compound NameN-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide
PubChem CID107733825
Molecular FormulaC15H16ClN3O2
Molecular Weight305.77 g/mol
Exact Mass305.09
IUPAC NameN-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide
SMILESCN(CC(=O)Nc1cc(N)ccc1Cl)c1cccc(O)c1
InChIInChI=1S/C15H16ClN3O2/c1-19(11-3-2-4-12(20)8-11)9-15(21)18-14-7-10(17)5-6-13(14)16/h2-8,20H,9,17H2,1H3,(H,18,21)
InChIKeyWXJKVOSCVLMULD-UHFFFAOYSA-N
XLogP2.70
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.77
LogP ≤ 52.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2,5-dichlorophenyl)-2-(N-methylanilino)acetamide
CID 2685123
N-(5-amino-2-fluorophenyl)-2-(N,3-dimethylanilino)acetamide
CID 62002218
2-(3-amino-N-methylanilino)-N-(2-methylphenyl)acetamide
CID 61297509
N-(5-amino-2-chlorophenyl)-2-[cycloheptyl(methyl)amino]acetamide
CID 43613723
2-(3-amino-N-methylanilino)-N-(3-chloro-4-methylphenyl)acetamide
CID 166855505
2-[[2-(5-amino-2-chloroanilino)-2-oxoethyl]-ethylamino]acetamide
CID 103101383
N-(5-amino-2-chlorophenyl)-2-[methyl(2-methylbutyl)amino]acetamide
CID 43376037
N-(4-amino-2-chlorophenyl)-2-(N,2-dimethylanilino)acetamide
CID 62003331
N-(5-amino-2-chlorophenyl)-2-[1-cyclopropylethyl(methyl)amino]acetamide
CID 43568654
N-(4-amino-2-methoxyphenyl)-2-(N-methylanilino)acetamide
CID 16779548
N-(5-amino-2-chlorophenyl)-2-[2-cyanopropyl(methyl)amino]acetamide
CID 54992924
N-(3-aminophenyl)-2-(N-methylanilino)acetamide
CID 16779401

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide?
The IUPAC name of N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide (CID 107733825) is N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide.
What is the SMILES notation for N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide?
The canonical SMILES for N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide is CN(CC(=O)Nc1cc(N)ccc1Cl)c1cccc(O)c1.
What is the InChIKey of N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide?
The InChIKey is WXJKVOSCVLMULD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O2/c1-19(11-3-2-4-12(20)8-11)9-15(21)18-14-7-10(17)5-6-13(14)16/h2-8,20H,9,17H2,1H3,(H,18,21).
What are the key properties of N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide?
N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide has a molecular weight of 305.77 g/mol, XLogP of 2.70, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-chlorophenyl)-2-(3-hydroxy-N-methylanilino)acetamide is sourced from PubChem (CID 107733825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).