N',N',2,2-tetramethylbutanediamide

C8H16N2O2 — CID 22673423

IUPACN',N',2,2-tetramethylbutanediamide
SMILESCN(C)C(=O)CC(C)(C)C(N)=O
InChIInChI=1S/C8H16N2O2/c1-8(2,7(9)12)5-6(11)10(3)4/h5H2,1-4H3,(H2,9,12)
InChIKeyGEQAHPRJUTWKLL-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.02
Rot. Bonds3

About N',N',2,2-tetramethylbutanediamide

N',N',2,2-tetramethylbutanediamide (PubChem CID 22673423) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is N',N',2,2-tetramethylbutanediamide.

Molecular Properties

Compound NameN',N',2,2-tetramethylbutanediamide
PubChem CID22673423
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC NameN',N',2,2-tetramethylbutanediamide
SMILESCN(C)C(=O)CC(C)(C)C(N)=O
InChIInChI=1S/C8H16N2O2/c1-8(2,7(9)12)5-6(11)10(3)4/h5H2,1-4H3,(H2,9,12)
InChIKeyGEQAHPRJUTWKLL-UHFFFAOYSA-N
XLogP-0.02
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N',N',2,2-tetramethylbutanediamide?
The IUPAC name of N',N',2,2-tetramethylbutanediamide (CID 22673423) is N',N',2,2-tetramethylbutanediamide.
What is the SMILES notation for N',N',2,2-tetramethylbutanediamide?
The canonical SMILES for N',N',2,2-tetramethylbutanediamide is CN(C)C(=O)CC(C)(C)C(N)=O.
What is the InChIKey of N',N',2,2-tetramethylbutanediamide?
The InChIKey is GEQAHPRJUTWKLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-8(2,7(9)12)5-6(11)10(3)4/h5H2,1-4H3,(H2,9,12).
What are the key properties of N',N',2,2-tetramethylbutanediamide?
N',N',2,2-tetramethylbutanediamide has a molecular weight of 172.23 g/mol, XLogP of -0.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N',2,2-tetramethylbutanediamide is sourced from PubChem (CID 22673423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).