N-tert-butyl-N-(2,2-dimethylpropyl)butanamide

C13H27NO — CID 118528660

IUPACN-tert-butyl-N-(2,2-dimethylpropyl)butanamide
SMILESCCCC(=O)N(CC(C)(C)C)C(C)(C)C
InChIInChI=1S/C13H27NO/c1-8-9-11(15)14(13(5,6)7)10-12(2,3)4/h8-10H2,1-7H3
InChIKeyJFOYBPLHCSAUBC-UHFFFAOYSA-N
MW213.36 g/mol
LogP3.46
Rot. Bonds3

About N-tert-butyl-N-(2,2-dimethylpropyl)butanamide

N-tert-butyl-N-(2,2-dimethylpropyl)butanamide (PubChem CID 118528660) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is N-tert-butyl-N-(2,2-dimethylpropyl)butanamide.

Molecular Properties

Compound NameN-tert-butyl-N-(2,2-dimethylpropyl)butanamide
PubChem CID118528660
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC NameN-tert-butyl-N-(2,2-dimethylpropyl)butanamide
SMILESCCCC(=O)N(CC(C)(C)C)C(C)(C)C
InChIInChI=1S/C13H27NO/c1-8-9-11(15)14(13(5,6)7)10-12(2,3)4/h8-10H2,1-7H3
InChIKeyJFOYBPLHCSAUBC-UHFFFAOYSA-N
XLogP3.46
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-tert-butylbutanehydrazide
CID 70295637
N-tert-butyl-N-(3,7-dimethylocta-2,6-dienyl)butanamide
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N-(2-aminopropan-2-yl)-N-(2,2-dimethylpropyl)propanamide
CID 123345232
N-(3,3-dimethylbutyl)-N-methylbutanamide;ethane
CID 176686856
N,N-dibromobutanamide
CID 154147629
N,N-dimethylbutanamide;hydrochloride
CID 87498306
N-(aminomethyl)-N-methylbutanamide
CID 155070465
N-[2-[butanoyl(tert-butyl)amino]phenyl]-N-tert-butylbutanamide
CID 175323632
N,N'-ditert-butyl-N,N'-diethyl-3-methylhexanediamide
CID 166236777
N,N-di(heptan-4-yl)butanamide
CID 89281674
2-amino-N-tert-butyl-N-ethylacetamide
CID 82183887
2-[tert-butyl(3-ethoxypropanoyl)amino]acetic acid
CID 79265770

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-N-(2,2-dimethylpropyl)butanamide?
The IUPAC name of N-tert-butyl-N-(2,2-dimethylpropyl)butanamide (CID 118528660) is N-tert-butyl-N-(2,2-dimethylpropyl)butanamide.
What is the SMILES notation for N-tert-butyl-N-(2,2-dimethylpropyl)butanamide?
The canonical SMILES for N-tert-butyl-N-(2,2-dimethylpropyl)butanamide is CCCC(=O)N(CC(C)(C)C)C(C)(C)C.
What is the InChIKey of N-tert-butyl-N-(2,2-dimethylpropyl)butanamide?
The InChIKey is JFOYBPLHCSAUBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-8-9-11(15)14(13(5,6)7)10-12(2,3)4/h8-10H2,1-7H3.
What are the key properties of N-tert-butyl-N-(2,2-dimethylpropyl)butanamide?
N-tert-butyl-N-(2,2-dimethylpropyl)butanamide has a molecular weight of 213.36 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-N-(2,2-dimethylpropyl)butanamide is sourced from PubChem (CID 118528660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).