2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide

C9H8Cl2N4O — CID 61373651

IUPAC2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide
SMILESCc1ccc(Cl)c(NC(=O)CN=[N+]=[N-])c1Cl
InChIInChI=1S/C9H8Cl2N4O/c1-5-2-3-6(10)9(8(5)11)14-7(16)4-13-15-12/h2-3H,4H2,1H3,(H,14,16)
InChIKeyZUANCMKJKARCPS-UHFFFAOYSA-N
MW259.10 g/mol
LogP3.55
Rot. Bonds3

About 2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide

2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide (PubChem CID 61373651) has the molecular formula C9H8Cl2N4O and a molecular weight of 259.10 g/mol. Its IUPAC name is 2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide
PubChem CID61373651
Molecular FormulaC9H8Cl2N4O
Molecular Weight259.10 g/mol
Exact Mass258.01
IUPAC Name2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide
SMILESCc1ccc(Cl)c(NC(=O)CN=[N+]=[N-])c1Cl
InChIInChI=1S/C9H8Cl2N4O/c1-5-2-3-6(10)9(8(5)11)14-7(16)4-13-15-12/h2-3H,4H2,1H3,(H,14,16)
InChIKeyZUANCMKJKARCPS-UHFFFAOYSA-N
XLogP3.55
TPSA77.86 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.10
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

3-(2,6-dichloro-3-methylanilino)-3-oxopropanoic acid
CID 62231070
(3Z)-3-amino-N-(2,6-dichloro-3-methylphenyl)-3-hydroxyiminopropanamide
CID 43156022
2-(tert-butylamino)-N-(2,6-dichloro-3-methylphenyl)acetamide
CID 27149947
6-(2,6-dichloro-3-methylanilino)-6-oxohexanoic acid
CID 43529433
N-(2,6-dichloro-3-methylphenyl)-2-ethoxyacetamide
CID 64591166
2-azido-N-(2,3-dichlorophenyl)acetamide
CID 55136750
[2-(2,6-dichloro-3-methylanilino)-2-oxoethyl]-[2-(methylamino)-2-oxoethyl]azanium
CID 8771647
5-bromo-N-(2,6-dichloro-3-methylphenyl)pentanamide
CID 107907179
2-(butan-2-ylamino)-N-(2,6-dichloro-3-methylphenyl)acetamide
CID 60646972
2-[[2-(2,6-dichloro-3-methylanilino)-2-oxoethyl]amino]-2-methylpropanoic acid
CID 65263564
2-azido-N-(2-chloro-5-fluorophenyl)acetamide
CID 112707918
2-azido-N-(2,6-difluorophenyl)acetamide
CID 55137363

Frequently Asked Questions

What is the IUPAC name of 2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide?
The IUPAC name of 2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide (CID 61373651) is 2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide.
What is the SMILES notation for 2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide?
The canonical SMILES for 2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide is Cc1ccc(Cl)c(NC(=O)CN=[N+]=[N-])c1Cl.
What is the InChIKey of 2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide?
The InChIKey is ZUANCMKJKARCPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8Cl2N4O/c1-5-2-3-6(10)9(8(5)11)14-7(16)4-13-15-12/h2-3H,4H2,1H3,(H,14,16).
What are the key properties of 2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide?
2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide has a molecular weight of 259.10 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azido-N-(2,6-dichloro-3-methylphenyl)acetamide is sourced from PubChem (CID 61373651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).