2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide

C16H15ClN2O2 — CID 43106968

IUPAC2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide
SMILESC/C(=N\O)c1ccccc1NC(=O)Cc1ccccc1Cl
InChIInChI=1S/C16H15ClN2O2/c1-11(19-21)13-7-3-5-9-15(13)18-16(20)10-12-6-2-4-8-14(12)17/h2-9,21H,10H2,1H3,(H,18,20)/b19-11+
InChIKeyMLLMFNIQUOBRCW-YBFXNURJSA-N
MW302.76 g/mol
LogP3.72
Rot. Bonds4

About 2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide

2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide (PubChem CID 43106968) has the molecular formula C16H15ClN2O2 and a molecular weight of 302.76 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide
PubChem CID43106968
Molecular FormulaC16H15ClN2O2
Molecular Weight302.76 g/mol
Exact Mass302.08
IUPAC Name2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide
SMILESC/C(=N\O)c1ccccc1NC(=O)Cc1ccccc1Cl
InChIInChI=1S/C16H15ClN2O2/c1-11(19-21)13-7-3-5-9-15(13)18-16(20)10-12-6-2-4-8-14(12)17/h2-9,21H,10H2,1H3,(H,18,20)/b19-11+
InChIKeyMLLMFNIQUOBRCW-YBFXNURJSA-N
XLogP3.72
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]benzamide
CID 24689515
2-[[2-(2-chlorophenyl)acetyl]amino]benzoic acid
CID 17296977
N-(2-benzoylphenyl)-2-(2-chlorophenyl)acetamide
CID 100633810
N-[2-(N-hydroxy-C-methylcarbonimidoyl)phenyl]acetamide
CID 71323651
N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]-3-methylbutanamide
CID 24702530
2-[[2-(2-chlorophenyl)acetyl]amino]-N-(2-phenylethyl)benzamide
CID 29456122
N-[(2R)-butan-2-yl]-2-[[2-(2-chlorophenyl)acetyl]amino]benzamide
CID 26706384
2-ethyl-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]butanamide
CID 24707294
N-(2-acetylphenyl)-2-(2,6-dichlorophenyl)acetamide
CID 4800695
2-(2-chlorophenyl)-N-(2-phenylphenyl)acetamide
CID 26727185
1-butyl-3-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]urea
CID 43210707
N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]-3-phenoxypropanamide
CID 24693923

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide (CID 43106968) is 2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide is C/C(=N\O)c1ccccc1NC(=O)Cc1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide?
The InChIKey is MLLMFNIQUOBRCW-YBFXNURJSA-N. The full InChI is InChI=1S/C16H15ClN2O2/c1-11(19-21)13-7-3-5-9-15(13)18-16(20)10-12-6-2-4-8-14(12)17/h2-9,21H,10H2,1H3,(H,18,20)/b19-11+.
What are the key properties of 2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide?
2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide has a molecular weight of 302.76 g/mol, XLogP of 3.72, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide is sourced from PubChem (CID 43106968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).