N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide

C11H14ClN3O3 — CID 108516000

IUPACN'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide
SMILESCC(O)CNC(=O)C(=O)Nc1ccc(N)cc1Cl
InChIInChI=1S/C11H14ClN3O3/c1-6(16)5-14-10(17)11(18)15-9-3-2-7(13)4-8(9)12/h2-4,6,16H,5,13H2,1H3,(H,14,17)(H,15,18)
InChIKeyRRIXNRVCCPPOMX-UHFFFAOYSA-N
MW271.70 g/mol
LogP0.36
Rot. Bonds3

About N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide

N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide (PubChem CID 108516000) has the molecular formula C11H14ClN3O3 and a molecular weight of 271.70 g/mol. Its IUPAC name is N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide.

Molecular Properties

Compound NameN'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide
PubChem CID108516000
Molecular FormulaC11H14ClN3O3
Molecular Weight271.70 g/mol
Exact Mass271.07
IUPAC NameN'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide
SMILESCC(O)CNC(=O)C(=O)Nc1ccc(N)cc1Cl
InChIInChI=1S/C11H14ClN3O3/c1-6(16)5-14-10(17)11(18)15-9-3-2-7(13)4-8(9)12/h2-4,6,16H,5,13H2,1H3,(H,14,17)(H,15,18)
InChIKeyRRIXNRVCCPPOMX-UHFFFAOYSA-N
XLogP0.36
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.70
LogP ≤ 50.36
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-(4-amino-2-chlorophenyl)-N-(2,2-dimethoxyethyl)oxamide
CID 108516166
N'-(2-amino-4-methylphenyl)-N-(2-hydroxypropyl)oxamide
CID 108521402
N'-(2,4-dimethylphenyl)-N-[(2S)-2-hydroxypropyl]oxamide
CID 7033220
N-(4-amino-2-chlorophenyl)-4-methylpentanamide
CID 28776887
N-(2-hydroxypropyl)-N'-(4-iodo-2-methylphenyl)oxamide
CID 47225790
1-(4-amino-2-chlorophenyl)-3-(3-methylbutyl)urea
CID 127574183
N'-(4-amino-2-chlorophenyl)-N-[2-(4-hydroxyphenyl)ethyl]oxamide
CID 108503034
N'-(5-chloro-2-methoxyphenyl)-N-[(2S)-2-hydroxypropyl]oxamide
CID 51471617
ethyl 4-[[2-(4-amino-2-chloroanilino)-2-oxoacetyl]amino]benzoate
CID 108500047
N'-(2,4-dichlorophenyl)-N-(4-hydroxy-2,2-dimethylpentyl)oxamide
CID 111490749
N-(4-amino-2-chlorophenyl)-2-methoxypropanamide
CID 16788780
N'-(4-amino-2-chlorophenyl)-N-(4-bromo-2-methylphenyl)oxamide
CID 108516290

Frequently Asked Questions

What is the IUPAC name of N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide?
The IUPAC name of N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide (CID 108516000) is N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide.
What is the SMILES notation for N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide?
The canonical SMILES for N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide is CC(O)CNC(=O)C(=O)Nc1ccc(N)cc1Cl.
What is the InChIKey of N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide?
The InChIKey is RRIXNRVCCPPOMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3O3/c1-6(16)5-14-10(17)11(18)15-9-3-2-7(13)4-8(9)12/h2-4,6,16H,5,13H2,1H3,(H,14,17)(H,15,18).
What are the key properties of N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide?
N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide has a molecular weight of 271.70 g/mol, XLogP of 0.36, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-amino-2-chlorophenyl)-N-(2-hydroxypropyl)oxamide is sourced from PubChem (CID 108516000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).