2-azido-N-(4-propylphenyl)acetamide

C11H14N4O — CID 61374209

IUPAC2-azido-N-(4-propylphenyl)acetamide
SMILESCCCc1ccc(NC(=O)CN=[N+]=[N-])cc1
InChIInChI=1S/C11H14N4O/c1-2-3-9-4-6-10(7-5-9)14-11(16)8-13-15-12/h4-7H,2-3,8H2,1H3,(H,14,16)
InChIKeyTXMYXJVSNCVOGE-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.89
Rot. Bonds5

About 2-azido-N-(4-propylphenyl)acetamide

2-azido-N-(4-propylphenyl)acetamide (PubChem CID 61374209) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-azido-N-(4-propylphenyl)acetamide.

Molecular Properties

Compound Name2-azido-N-(4-propylphenyl)acetamide
PubChem CID61374209
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name2-azido-N-(4-propylphenyl)acetamide
SMILESCCCc1ccc(NC(=O)CN=[N+]=[N-])cc1
InChIInChI=1S/C11H14N4O/c1-2-3-9-4-6-10(7-5-9)14-11(16)8-13-15-12/h4-7H,2-3,8H2,1H3,(H,14,16)
InChIKeyTXMYXJVSNCVOGE-UHFFFAOYSA-N
XLogP2.89
TPSA77.86 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.89
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

2-amino-N-(4-propylphenyl)acetamide
CID 43216495
N-[4-(2-azidoacetyl)phenyl]propanamide
CID 98883079
2-methylsulfanyl-N-(4-propylphenyl)acetamide
CID 112765657
2-phenyl-N-(4-propylphenyl)acetamide
CID 126501660
5-(aminomethylideneamino)-N-(4-propylphenyl)pentanamide
CID 146365778
N-phenyl-2-(4-propylanilino)acetamide
CID 43215416
3-(cyclopropylamino)-N-(4-propylphenyl)propanamide
CID 54924971
2-methyl-N-(4-propylphenyl)propanamide
CID 58658667
2-azido-N-(3-methylsulfanylphenyl)acetamide
CID 52940390
2-(4-aminophenoxy)-N-(4-propylphenyl)acetamide
CID 61027141
2-(2-methoxyethoxy)-N-(4-propylphenyl)acetamide
CID 103606707
4-amino-3,3-dimethyl-N-(4-propylphenyl)butanamide
CID 115157180

Frequently Asked Questions

What is the IUPAC name of 2-azido-N-(4-propylphenyl)acetamide?
The IUPAC name of 2-azido-N-(4-propylphenyl)acetamide (CID 61374209) is 2-azido-N-(4-propylphenyl)acetamide.
What is the SMILES notation for 2-azido-N-(4-propylphenyl)acetamide?
The canonical SMILES for 2-azido-N-(4-propylphenyl)acetamide is CCCc1ccc(NC(=O)CN=[N+]=[N-])cc1.
What is the InChIKey of 2-azido-N-(4-propylphenyl)acetamide?
The InChIKey is TXMYXJVSNCVOGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-2-3-9-4-6-10(7-5-9)14-11(16)8-13-15-12/h4-7H,2-3,8H2,1H3,(H,14,16).
What are the key properties of 2-azido-N-(4-propylphenyl)acetamide?
2-azido-N-(4-propylphenyl)acetamide has a molecular weight of 218.26 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azido-N-(4-propylphenyl)acetamide is sourced from PubChem (CID 61374209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).