2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide

C14H20N2O2 — CID 114628289

IUPAC2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
SMILESCC1(C)C(O)CC1NC(=O)Cc1ccccc1N
InChIInChI=1S/C14H20N2O2/c1-14(2)11(8-12(14)17)16-13(18)7-9-5-3-4-6-10(9)15/h3-6,11-12,17H,7-8,15H2,1-2H3,(H,16,18)
InChIKeyXYRZNHANRSHAQZ-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.09
Rot. Bonds3

About 2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide

2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide (PubChem CID 114628289) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
PubChem CID114628289
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
SMILESCC1(C)C(O)CC1NC(=O)Cc1ccccc1N
InChIInChI=1S/C14H20N2O2/c1-14(2)11(8-12(14)17)16-13(18)7-9-5-3-4-6-10(9)15/h3-6,11-12,17H,7-8,15H2,1-2H3,(H,16,18)
InChIKeyXYRZNHANRSHAQZ-UHFFFAOYSA-N
XLogP1.09
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(2-aminophenyl)-N-(2,2-dimethylcyclohexyl)acetamide
CID 79855624
4-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-4-phenylbutanamide
CID 114629642
N-(3-amino-2,2-dimethylcyclobutyl)-2-(2-fluorophenyl)acetamide
CID 114632325
3-(benzenesulfonyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)propanamide
CID 114631237
2-(2-aminophenyl)-N-methylacetamide
CID 16772909
5-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)pentanamide
CID 114629795
(2R)-2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)butanamide
CID 104940471
2-(benzimidazol-1-yl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
CID 114630853
2-(5-amino-2-oxo-1-pyridinyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
CID 114628271
3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide
CID 114628267
N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methylbutanamide
CID 114631068
2-(2-aminophenyl)-N-(thian-4-yl)acetamide
CID 115753416

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide?
The IUPAC name of 2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide (CID 114628289) is 2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide is CC1(C)C(O)CC1NC(=O)Cc1ccccc1N.
What is the InChIKey of 2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide?
The InChIKey is XYRZNHANRSHAQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-14(2)11(8-12(14)17)16-13(18)7-9-5-3-4-6-10(9)15/h3-6,11-12,17H,7-8,15H2,1-2H3,(H,16,18).
What are the key properties of 2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide?
2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.09, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide is sourced from PubChem (CID 114628289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).