N-(2-diazenylethyl)-2,2-dimethylpropanamide

C7H15N3O — CID 147030437

IUPACN-(2-diazenylethyl)-2,2-dimethylpropanamide
SMILES[H]/N=N/CCNC(=O)C(C)(C)C
InChIInChI=1S/C7H15N3O/c1-7(2,3)6(11)9-4-5-10-8/h8H,4-5H2,1-3H3,(H,9,11)/b10-8+
InChIKeyAXMKOZWHGKSDMC-CSKARUKUSA-N
MW157.22 g/mol
LogP1.18
Rot. Bonds3

About N-(2-diazenylethyl)-2,2-dimethylpropanamide

N-(2-diazenylethyl)-2,2-dimethylpropanamide (PubChem CID 147030437) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is N-(2-diazenylethyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(2-diazenylethyl)-2,2-dimethylpropanamide
PubChem CID147030437
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC NameN-(2-diazenylethyl)-2,2-dimethylpropanamide
SMILES[H]/N=N/CCNC(=O)C(C)(C)C
InChIInChI=1S/C7H15N3O/c1-7(2,3)6(11)9-4-5-10-8/h8H,4-5H2,1-3H3,(H,9,11)/b10-8+
InChIKeyAXMKOZWHGKSDMC-CSKARUKUSA-N
XLogP1.18
TPSA65.31 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-diazenylethyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(2-diazenylethyl)-2,2-dimethylpropanamide (CID 147030437) is N-(2-diazenylethyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(2-diazenylethyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(2-diazenylethyl)-2,2-dimethylpropanamide is [H]/N=N/CCNC(=O)C(C)(C)C.
What is the InChIKey of N-(2-diazenylethyl)-2,2-dimethylpropanamide?
The InChIKey is AXMKOZWHGKSDMC-CSKARUKUSA-N. The full InChI is InChI=1S/C7H15N3O/c1-7(2,3)6(11)9-4-5-10-8/h8H,4-5H2,1-3H3,(H,9,11)/b10-8+.
What are the key properties of N-(2-diazenylethyl)-2,2-dimethylpropanamide?
N-(2-diazenylethyl)-2,2-dimethylpropanamide has a molecular weight of 157.22 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-diazenylethyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 147030437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).