2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide

C11H22N2O2 — CID 108957169

IUPAC2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide
SMILESCC(C)NC(=O)C(C)(C)C(=O)NC(C)C
InChIInChI=1S/C11H22N2O2/c1-7(2)12-9(14)11(5,6)10(15)13-8(3)4/h7-8H,1-6H3,(H,12,14)(H,13,15)
InChIKeyNEZWJTMGVLDWHA-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.06
Rot. Bonds4

About 2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide

2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide (PubChem CID 108957169) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide.

Molecular Properties

Compound Name2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide
PubChem CID108957169
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide
SMILESCC(C)NC(=O)C(C)(C)C(=O)NC(C)C
InChIInChI=1S/C11H22N2O2/c1-7(2)12-9(14)11(5,6)10(15)13-8(3)4/h7-8H,1-6H3,(H,12,14)(H,13,15)
InChIKeyNEZWJTMGVLDWHA-UHFFFAOYSA-N
XLogP1.06
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

2,2-dimethyl-N-propan-2-yl-N'-propylpropanediamide
CID 108956970
2,2-difluoro-N-propan-2-ylpropanamide
CID 130495307
2,2-dimethyl-N-(1-phenylethyl)-N'-propan-2-ylpropanediamide
CID 108957197
2-methyl-2-(methylamino)-N-propan-2-ylpropanamide
CID 62835801
2,2-dimethyl-N-(4-methylphenyl)-N'-propan-2-ylpropanediamide
CID 108957263
2,2-dimethyl-N'-propan-2-yl-N,N-dipropylpropanediamide
CID 108957255
N-(4-acetylphenyl)-2,2-dimethyl-N'-propan-2-ylpropanediamide
CID 108957314
2,2,4-trimethyl-N-propan-2-ylpentanamide
CID 126707660
2-methyl-N-propan-2-yl-2-sulfanylbutanamide
CID 176964784
2,2-difluoro-3-methyl-N-propan-2-ylbutanamide
CID 170077230
2,2,3,3,4,4,5,5-octafluoro-N,N'-di(propan-2-yl)hexanediamide
CID 3089678
2,2-dimethyl-4-oxo-N-propan-2-ylbutanamide
CID 141082926

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide?
The IUPAC name of 2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide (CID 108957169) is 2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide.
What is the SMILES notation for 2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide?
The canonical SMILES for 2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide is CC(C)NC(=O)C(C)(C)C(=O)NC(C)C.
What is the InChIKey of 2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide?
The InChIKey is NEZWJTMGVLDWHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-7(2)12-9(14)11(5,6)10(15)13-8(3)4/h7-8H,1-6H3,(H,12,14)(H,13,15).
What are the key properties of 2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide?
2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide has a molecular weight of 214.31 g/mol, XLogP of 1.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N,N'-di(propan-2-yl)propanediamide is sourced from PubChem (CID 108957169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).