(2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide

C12H24N2O2 — CID 104878201

IUPAC(2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide
SMILESCCOC1CC(NC(=O)[C@H](N)CC)C1(C)C
InChIInChI=1S/C12H24N2O2/c1-5-8(13)11(15)14-9-7-10(16-6-2)12(9,3)4/h8-10H,5-7,13H2,1-4H3,(H,14,15)/t8-,9?,10?/m1/s1
InChIKeyGJIZGCKKBXQBDM-XNWIYYODSA-N
MW228.34 g/mol
LogP1.04
Rot. Bonds5

About (2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide

(2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide (PubChem CID 104878201) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is (2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide
PubChem CID104878201
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name(2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide
SMILESCCOC1CC(NC(=O)[C@H](N)CC)C1(C)C
InChIInChI=1S/C12H24N2O2/c1-5-8(13)11(15)14-9-7-10(16-6-2)12(9,3)4/h8-10H,5-7,13H2,1-4H3,(H,14,15)/t8-,9?,10?/m1/s1
InChIKeyGJIZGCKKBXQBDM-XNWIYYODSA-N
XLogP1.04
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide
CID 103797512
4-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-methylbutanamide
CID 114119108
(2R)-2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)butanamide
CID 104940471
2-(1-aminocyclobutyl)-N-(3-ethoxy-2,2-dimethylcyclobutyl)acetamide
CID 103812092
(2S)-2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-4-methylpentanamide
CID 103812819
2-(2-aminoethoxy)-N-(3-ethoxy-2,2-dimethylcyclobutyl)acetamide
CID 103812070
1-(3-ethoxy-2,2-dimethylcyclobutyl)-2-ethylguanidine
CID 103734487
6-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-6-oxohexanoic acid
CID 114118834
ethyl 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanoate
CID 64688546
N-cyclopropyl-2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide
CID 112696347
(2S)-2-amino-N-(3-butoxy-2,2-dimethylcyclobutyl)-3,3-dimethylbutanamide
CID 119819267
2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-methylpropanamide
CID 64851351

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide?
The IUPAC name of (2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide (CID 104878201) is (2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide.
What is the SMILES notation for (2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide?
The canonical SMILES for (2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide is CCOC1CC(NC(=O)[C@H](N)CC)C1(C)C.
What is the InChIKey of (2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide?
The InChIKey is GJIZGCKKBXQBDM-XNWIYYODSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-5-8(13)11(15)14-9-7-10(16-6-2)12(9,3)4/h8-10H,5-7,13H2,1-4H3,(H,14,15)/t8-,9?,10?/m1/s1.
What are the key properties of (2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide?
(2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide has a molecular weight of 228.34 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)butanamide is sourced from PubChem (CID 104878201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).