N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide

C7H14N2O — CID 118408689

IUPACN-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide
SMILESC/N=C(/NC(C)=O)C(C)C
InChIInChI=1S/C7H14N2O/c1-5(2)7(8-4)9-6(3)10/h5H,1-4H3,(H,8,9,10)
InChIKeyPCZJLZXTBHQBBZ-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.81
Rot. Bonds1

About N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide

N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide (PubChem CID 118408689) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide.

Molecular Properties

Compound NameN-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide
PubChem CID118408689
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC NameN-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide
SMILESC/N=C(/NC(C)=O)C(C)C
InChIInChI=1S/C7H14N2O/c1-5(2)7(8-4)9-6(3)10/h5H,1-4H3,(H,8,9,10)
InChIKeyPCZJLZXTBHQBBZ-UHFFFAOYSA-N
XLogP0.81
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.81
H-Bond Donors ≤ 51
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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Related Compounds

2-Ethyl-3,5-dihydroimidazol-4-one
CID 57435862
2-Propan-2-yl-1,4-dihydroimidazol-5-one
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2-propan-2-yl-4,5-dihydro-1H-pyrimidin-6-one
CID 22898627
2,5-dimethyl-4,5-dihydro-1H-pyrimidin-6-one
CID 55287748
2-(2-Methylpropyl)-1,4-dihydroimidazol-5-one
CID 58718521
2-ethyl-4,5-dihydro-1H-pyrimidin-6-one
CID 69298206
N-(N-methyl-C-propylcarbonimidoyl)acetamide
CID 88928598
N-(C,N-dimethylcarbonimidoyl)propanamide
CID 89227228
N-(C,N-dimethylcarbonimidoyl)acetamide
CID 89494913
N-(C-cyclopropyl-N-methylcarbonimidoyl)propanamide
CID 118327148
N-(C-ethyl-N-methylcarbonimidoyl)acetamide
CID 118527281
N-(1-acetamidoethylidene)-2-methylpropanamide
CID 123825715

Frequently Asked Questions

What is the IUPAC name of N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide?
The IUPAC name of N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide (CID 118408689) is N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide.
What is the SMILES notation for N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide?
The canonical SMILES for N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide is C/N=C(/NC(C)=O)C(C)C.
What is the InChIKey of N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide?
The InChIKey is PCZJLZXTBHQBBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-5(2)7(8-4)9-6(3)10/h5H,1-4H3,(H,8,9,10).
What are the key properties of N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide?
N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide has a molecular weight of 142.20 g/mol, XLogP of 0.81, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(N-methyl-C-propan-2-ylcarbonimidoyl)acetamide is sourced from PubChem (CID 118408689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).