N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide

C11H22N2O — CID 114632383

IUPACN-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide
SMILESCCC(C)C(=O)NC1CC(N)C1(C)C
InChIInChI=1S/C11H22N2O/c1-5-7(2)10(14)13-9-6-8(12)11(9,3)4/h7-9H,5-6,12H2,1-4H3,(H,13,14)
InChIKeyOOJVSFVLOCMXTH-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.27
Rot. Bonds3

About N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide

N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide (PubChem CID 114632383) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide
PubChem CID114632383
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide
SMILESCCC(C)C(=O)NC1CC(N)C1(C)C
InChIInChI=1S/C11H22N2O/c1-5-7(2)10(14)13-9-6-8(12)11(9,3)4/h7-9H,5-6,12H2,1-4H3,(H,13,14)
InChIKeyOOJVSFVLOCMXTH-UHFFFAOYSA-N
XLogP1.27
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl N-(3-amino-2,2-dimethylcyclobutyl)carbamate
CID 114632504
N-(2,2-dimethylthietan-3-yl)-2-methylbutanamide
CID 126989201
4-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-methylbutanamide
CID 114119108
(2R)-2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)butanamide
CID 104940471
N-(3-amino-2,2-dimethylcyclobutyl)-4,4,4-trifluorobutanamide
CID 114632369
6-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylheptanamide
CID 114629788
N-(3-amino-2,2-dimethylcyclobutyl)-2-(2-fluorophenyl)acetamide
CID 114632325
N-(3-amino-2,2-dimethylcyclobutyl)bicyclo[3.1.0]hexane-6-carboxamide
CID 114632374
(2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide
CID 104878201
(2S)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide
CID 103797512
(2R)-N-cyclobutyl-2-methylbutanamide
CID 129182523
N-[(1R,2R)-2-aminocyclohexyl]-2-methylbutanamide
CID 103805727

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide?
The IUPAC name of N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide (CID 114632383) is N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide?
The canonical SMILES for N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide is CCC(C)C(=O)NC1CC(N)C1(C)C.
What is the InChIKey of N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide?
The InChIKey is OOJVSFVLOCMXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-5-7(2)10(14)13-9-6-8(12)11(9,3)4/h7-9H,5-6,12H2,1-4H3,(H,13,14).
What are the key properties of N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide?
N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide has a molecular weight of 198.31 g/mol, XLogP of 1.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylcyclobutyl)-2-methylbutanamide is sourced from PubChem (CID 114632383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).