2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide

C17H17Cl2N3O3 — CID 23645835

IUPAC2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide
SMILESCC(C(=O)NO)N(Cc1ccccc1Cl)C(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C17H17Cl2N3O3/c1-11(16(23)21-25)22(10-12-5-2-3-8-15(12)19)17(24)20-14-7-4-6-13(18)9-14/h2-9,11,25H,10H2,1H3,(H,20,24)(H,21,23)
InChIKeyXRNBBNSPGDGYNF-UHFFFAOYSA-N
MW382.25 g/mol
LogP3.92
Rot. Bonds5

About 2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide

2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide (PubChem CID 23645835) has the molecular formula C17H17Cl2N3O3 and a molecular weight of 382.25 g/mol. Its IUPAC name is 2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide.

Molecular Properties

Compound Name2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide
PubChem CID23645835
Molecular FormulaC17H17Cl2N3O3
Molecular Weight382.25 g/mol
Exact Mass381.06
IUPAC Name2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide
SMILESCC(C(=O)NO)N(Cc1ccccc1Cl)C(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C17H17Cl2N3O3/c1-11(16(23)21-25)22(10-12-5-2-3-8-15(12)19)17(24)20-14-7-4-6-13(18)9-14/h2-9,11,25H,10H2,1H3,(H,20,24)(H,21,23)
InChIKeyXRNBBNSPGDGYNF-UHFFFAOYSA-N
XLogP3.92
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.25
LogP ≤ 53.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(4-Benzyl-1-piperazinyl)-N-(3-chloro-4-methylphenyl)acetamide
CID 1206470
3-(3-Chloro-4-methylphenyl)-1,1-dibenzylurea
CID 3498635
3-(3-Chloro-4-methylphenyl)-1,1-dibutylurea
CID 4363246
(2S)-2-{[(2-chlorophenyl)methyl][(4-fluorophenyl)carbamoyl]amino}-N-hydroxypropanamide
CID 23645834
2-{[(2-chlorophenyl)methyl][(2,4-difluorophenyl)carbamoyl]amino}-N-hydroxypropanamide
CID 23645837
N-4-Fluorophenylureido-N-2-chlorobenzyl-L-alanine
CID 23645821
N-(3-chloro-4-methylphenyl)-2-(cyclohexylamino)acetamide
CID 237729
N-(3,5-dichlorophenyl)-2-(dimethylamino)-2-phenylacetamide
CID 3450156
N-(3-chloro-4-methylphenyl)-2-(dimethylamino)-2-phenylacetamide
CID 4324124
N-benzyl-2-[4-(3-chlorophenyl)piperazin-1-yl]acetamide
CID 6470463
N-(3-chlorophenyl)-N'-[4-(2-oxo-1-pyrrolidinyl)benzyl]urea
CID 894197
(R)-N2-(4-Chlorobenzyl)-N2-methyl-N1-p-tolylpyrrolidine-1,2-dicarboxamide
CID 25233579

Frequently Asked Questions

What is the IUPAC name of 2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide?
The IUPAC name of 2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide (CID 23645835) is 2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide.
What is the SMILES notation for 2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide?
The canonical SMILES for 2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide is CC(C(=O)NO)N(Cc1ccccc1Cl)C(=O)Nc1cccc(Cl)c1.
What is the InChIKey of 2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide?
The InChIKey is XRNBBNSPGDGYNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17Cl2N3O3/c1-11(16(23)21-25)22(10-12-5-2-3-8-15(12)19)17(24)20-14-7-4-6-13(18)9-14/h2-9,11,25H,10H2,1H3,(H,20,24)(H,21,23).
What are the key properties of 2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide?
2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide has a molecular weight of 382.25 g/mol, XLogP of 3.92, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chlorophenyl)carbamoyl-[(2-chlorophenyl)methyl]amino]-N-hydroxypropanamide is sourced from PubChem (CID 23645835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).