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

C10H20N2O — CID 166897461

IUPACN-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide
SMILESC/N=C(\C(C)C)N(C(C)=O)C(C)C
InChIInChI=1S/C10H20N2O/c1-7(2)10(11-6)12(8(3)4)9(5)13/h7-8H,1-6H3/b11-10+
InChIKeyKOVGRIKEYYDWJA-ZHACJKMWSA-N
MW184.28 g/mol
LogP1.93
Rot. Bonds2

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

N-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide (PubChem CID 166897461) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide.

Molecular Properties

Compound NameN-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide
PubChem CID166897461
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide
SMILESC/N=C(\C(C)C)N(C(C)=O)C(C)C
InChIInChI=1S/C10H20N2O/c1-7(2)10(11-6)12(8(3)4)9(5)13/h7-8H,1-6H3/b11-10+
InChIKeyKOVGRIKEYYDWJA-ZHACJKMWSA-N
XLogP1.93
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.93
H-Bond Donors ≤ 50
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-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide?
The IUPAC name of N-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide (CID 166897461) is N-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide.
What is the SMILES notation for N-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide?
The canonical SMILES for N-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide is C/N=C(\C(C)C)N(C(C)=O)C(C)C.
What is the InChIKey of N-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide?
The InChIKey is KOVGRIKEYYDWJA-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H20N2O/c1-7(2)10(11-6)12(8(3)4)9(5)13/h7-8H,1-6H3/b11-10+.
What are the key properties of N-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide?
N-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide has a molecular weight of 184.28 g/mol, XLogP of 1.93, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(N-methyl-C-propan-2-ylcarbonimidoyl)-N-propan-2-ylacetamide is sourced from PubChem (CID 166897461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).