N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide

C11H22N2O2 — CID 3786773

IUPACN-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NCNC(=O)C(C)(C)C
InChIInChI=1S/C11H22N2O2/c1-10(2,3)8(14)12-7-13-9(15)11(4,5)6/h7H2,1-6H3,(H,12,14)(H,13,15)
InChIKeyIJSFIXHONRJSGX-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.27
Rot. Bonds2

About N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide

N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide (PubChem CID 3786773) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide
PubChem CID3786773
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NCNC(=O)C(C)(C)C
InChIInChI=1S/C11H22N2O2/c1-10(2,3)8(14)12-7-13-9(15)11(4,5)6/h7H2,1-6H3,(H,12,14)(H,13,15)
InChIKeyIJSFIXHONRJSGX-UHFFFAOYSA-N
XLogP1.27
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-Isobutylidenedipivalamide
CID 132235
N-methylene bispropionamide
CID 15273003
N-[bis(propanoylamino)methyl]propanamide
CID 15326915
N-[bis(butanoylamino)methyl]butanamide
CID 44719771
N-(1-acetamido-2,2-dimethylpropyl)acetamide
CID 14691992
3-trimethylstannyl-N-[(3-trimethylstannylpropanoylamino)methyl]propanamide
CID 12901412
N-(acetamidomethyl)propanamide
CID 20653399
N-[[methyl(propanoyl)amino]methyl]propanamide
CID 20671552
2-methyl-N-(methylaminomethyl)propanamide
CID 20681670
(2,2-Dimethylbutanoylamino)methyl-trimethylazanium
CID 20718214
N-[(dimethylamino)methyl]-2,2-dimethylbutanamide
CID 20718215
2-methyl-N-[(2-methylbutanoylamino)methyl]butanamide
CID 20789927

Frequently Asked Questions

What is the IUPAC name of N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide (CID 3786773) is N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide is CC(C)(C)C(=O)NCNC(=O)C(C)(C)C.
What is the InChIKey of N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide?
The InChIKey is IJSFIXHONRJSGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-10(2,3)8(14)12-7-13-9(15)11(4,5)6/h7H2,1-6H3,(H,12,14)(H,13,15).
What are the key properties of N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide?
N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide has a molecular weight of 214.31 g/mol, XLogP of 1.27, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2-dimethylpropanoylamino)methyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 3786773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).