2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide

C15H29NO — CID 146286386

IUPAC2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide
SMILESCC(C)(C)C(C(=O)NCC1CCC1)C(C)(C)C
InChIInChI=1S/C15H29NO/c1-14(2,3)12(15(4,5)6)13(17)16-10-11-8-7-9-11/h11-12H,7-10H2,1-6H3,(H,16,17)
InChIKeyCXRNHQWTRYTKMS-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.61
Rot. Bonds3

About 2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide

2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide (PubChem CID 146286386) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide.

Molecular Properties

Compound Name2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide
PubChem CID146286386
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide
SMILESCC(C)(C)C(C(=O)NCC1CCC1)C(C)(C)C
InChIInChI=1S/C15H29NO/c1-14(2,3)12(15(4,5)6)13(17)16-10-11-8-7-9-11/h11-12H,7-10H2,1-6H3,(H,16,17)
InChIKeyCXRNHQWTRYTKMS-UHFFFAOYSA-N
XLogP3.61
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-amino-N-(cyclobutylmethyl)-3-methylbutanamide
CID 79011849
(2S)-2-amino-N-(cyclooctylmethyl)-3,3-dimethylbutanamide;hydrochloride
CID 119741871
N-(cyclopentylmethyl)-2-methylpropanamide
CID 58333395
N-(cyclopentylmethyl)-2-methylpropanamide;ethane
CID 176960669
N-(cyclobutylmethyl)-2-methyl-3-(methylamino)propanamide
CID 79196076
tert-butyl N-(cyclobutylmethyl)carbamate
CID 23087339
3-amino-N-(cyclobutylmethyl)-2-hydroxypropanamide
CID 115180610
2-amino-N-(cyclohexylmethyl)propanamide
CID 43215382
2-amino-N-(cyclobutylmethyl)-3-methoxypropanamide
CID 81080963
N-(cyclobutylmethyl)-3-(ethylamino)-2-methylpropanamide
CID 62853240
2-amino-N-(cyclooctylmethyl)propanamide;hydrochloride
CID 119299452
N-(2-cyclopentylethyl)-2-methoxypropanamide
CID 115588216

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide?
The IUPAC name of 2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide (CID 146286386) is 2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide.
What is the SMILES notation for 2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide?
The canonical SMILES for 2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide is CC(C)(C)C(C(=O)NCC1CCC1)C(C)(C)C.
What is the InChIKey of 2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide?
The InChIKey is CXRNHQWTRYTKMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-14(2,3)12(15(4,5)6)13(17)16-10-11-8-7-9-11/h11-12H,7-10H2,1-6H3,(H,16,17).
What are the key properties of 2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide?
2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide has a molecular weight of 239.40 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-N-(cyclobutylmethyl)-3,3-dimethylbutanamide is sourced from PubChem (CID 146286386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).