N-ethanimidoyl-2,2-dimethylpropanamide

C7H14N2O — CID 165356844

IUPACN-ethanimidoyl-2,2-dimethylpropanamide
SMILES[H]/N=C(\C)NC(=O)C(C)(C)C
InChIInChI=1S/C7H14N2O/c1-5(8)9-6(10)7(2,3)4/h1-4H3,(H2,8,9,10)
InChIKeyLNGRBOWFLBEIHK-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.15
Rot. Bonds

About N-ethanimidoyl-2,2-dimethylpropanamide

N-ethanimidoyl-2,2-dimethylpropanamide (PubChem CID 165356844) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is N-ethanimidoyl-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-ethanimidoyl-2,2-dimethylpropanamide
PubChem CID165356844
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC NameN-ethanimidoyl-2,2-dimethylpropanamide
SMILES[H]/N=C(\C)NC(=O)C(C)(C)C
InChIInChI=1S/C7H14N2O/c1-5(8)9-6(10)7(2,3)4/h1-4H3,(H2,8,9,10)
InChIKeyLNGRBOWFLBEIHK-UHFFFAOYSA-N
XLogP1.15
TPSA52.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethanimidoyl-2,2-dimethylpropanamide?
The IUPAC name of N-ethanimidoyl-2,2-dimethylpropanamide (CID 165356844) is N-ethanimidoyl-2,2-dimethylpropanamide.
What is the SMILES notation for N-ethanimidoyl-2,2-dimethylpropanamide?
The canonical SMILES for N-ethanimidoyl-2,2-dimethylpropanamide is [H]/N=C(\C)NC(=O)C(C)(C)C.
What is the InChIKey of N-ethanimidoyl-2,2-dimethylpropanamide?
The InChIKey is LNGRBOWFLBEIHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-5(8)9-6(10)7(2,3)4/h1-4H3,(H2,8,9,10).
What are the key properties of N-ethanimidoyl-2,2-dimethylpropanamide?
N-ethanimidoyl-2,2-dimethylpropanamide has a molecular weight of 142.20 g/mol, XLogP of 1.15, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethanimidoyl-2,2-dimethylpropanamide is sourced from PubChem (CID 165356844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).