2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide

C12H24N2O2 — CID 114629833

IUPAC2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NC1CC(O)C1(C)C
InChIInChI=1S/C12H24N2O2/c1-5-6-12(4,13)10(16)14-8-7-9(15)11(8,2)3/h8-9,15H,5-7,13H2,1-4H3,(H,14,16)
InChIKeyNISMAACAASZHDD-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.78
Rot. Bonds4

About 2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide

2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide (PubChem CID 114629833) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide
PubChem CID114629833
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NC1CC(O)C1(C)C
InChIInChI=1S/C12H24N2O2/c1-5-6-12(4,13)10(16)14-8-7-9(15)11(8,2)3/h8-9,15H,5-7,13H2,1-4H3,(H,14,16)
InChIKeyNISMAACAASZHDD-UHFFFAOYSA-N
XLogP0.78
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylbutanamide
CID 114629647
2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-methylpentanamide
CID 113267255
2-amino-N-(3-butoxy-2,2-dimethylcyclobutyl)-2-methylpentanamide;hydrochloride
CID 119819292
2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride
CID 119803524
2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide
CID 107222009
(2R)-2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)pentanamide
CID 107570804
(2R)-2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)butanamide
CID 104940471
2-(aminomethyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)pentanamide
CID 114629813
2-amino-N-[(3-hydroxycyclobutyl)methyl]-2-methylpentanamide
CID 66004244
2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
CID 114629789
(2S)-2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)hexanamide
CID 107146718
N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methoxy-3-methylbutanamide
CID 103021218

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide?
The IUPAC name of 2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide (CID 114629833) is 2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide.
What is the SMILES notation for 2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide?
The canonical SMILES for 2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide is CCCC(C)(N)C(=O)NC1CC(O)C1(C)C.
What is the InChIKey of 2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide?
The InChIKey is NISMAACAASZHDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-5-6-12(4,13)10(16)14-8-7-9(15)11(8,2)3/h8-9,15H,5-7,13H2,1-4H3,(H,14,16).
What are the key properties of 2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide?
2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide has a molecular weight of 228.34 g/mol, XLogP of 0.78, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylpentanamide is sourced from PubChem (CID 114629833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).