2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide

C15H22N2O2 — CID 103812779

IUPAC2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide
SMILESCOC1CC(NC(=O)Cc2ccc(N)cc2)C1(C)C
InChIInChI=1S/C15H22N2O2/c1-15(2)12(9-13(15)19-3)17-14(18)8-10-4-6-11(16)7-5-10/h4-7,12-13H,8-9,16H2,1-3H3,(H,17,18)
InChIKeyNVMFPIIKHPVFDG-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.74
Rot. Bonds4

About 2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide

2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide (PubChem CID 103812779) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide.

Molecular Properties

Compound Name2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide
PubChem CID103812779
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide
SMILESCOC1CC(NC(=O)Cc2ccc(N)cc2)C1(C)C
InChIInChI=1S/C15H22N2O2/c1-15(2)12(9-13(15)19-3)17-14(18)8-10-4-6-11(16)7-5-10/h4-7,12-13H,8-9,16H2,1-3H3,(H,17,18)
InChIKeyNVMFPIIKHPVFDG-UHFFFAOYSA-N
XLogP1.74
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

Fepratset
CID 165035
2-Azetidinone, 3-(p-aminophenyl)-3-ethyl-
CID 52683
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CID 3046175
2-(4-aminophenyl)-N-ethylacetamide
CID 16770722
4-Amino-N-(1-methyl-2-phenylethyl)benzeneacetamide hydrochloride
CID 2845128
2-(4-aminophenyl)-N-methyl-N-propan-2-ylacetamide
CID 16786559
3-(4-aminophenyl)-N-cyclopropylpropanamide
CID 1508557
2-(4-aminophenyl)-N-(2-methoxyethyl)acetamide
CID 16777152
N-Butyl-1-(4-acetamidophenyl)cyclobutane-1-carboxamide
CID 53110547
1-[4-(acetylamino)phenyl]-N~1~-cyclopropyl-1-cyclobutanecarboxamide
CID 53110548
N-(Propan-2-YL)-1-(4-propanamidophenyl)cyclobutane-1-carboxamide
CID 53110573
4-acetamido-N-(3-ethoxy-2,2-dimethylcyclobutyl)-N-methylbenzamide
CID 72004126

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide?
The IUPAC name of 2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide (CID 103812779) is 2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide.
What is the SMILES notation for 2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide?
The canonical SMILES for 2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide is COC1CC(NC(=O)Cc2ccc(N)cc2)C1(C)C.
What is the InChIKey of 2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide?
The InChIKey is NVMFPIIKHPVFDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-15(2)12(9-13(15)19-3)17-14(18)8-10-4-6-11(16)7-5-10/h4-7,12-13H,8-9,16H2,1-3H3,(H,17,18).
What are the key properties of 2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide?
2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide has a molecular weight of 262.35 g/mol, XLogP of 1.74, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide is sourced from PubChem (CID 103812779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).