2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide

C14H18N2O3 — CID 82057064

IUPAC2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide
SMILESNc1cc(C=O)ccc1OCC(=O)NC1CCCC1
InChIInChI=1S/C14H18N2O3/c15-12-7-10(8-17)5-6-13(12)19-9-14(18)16-11-3-1-2-4-11/h5-8,11H,1-4,9,15H2,(H,16,18)
InChIKeyJWZUYTNUNVTFGQ-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.52
Rot. Bonds5

About 2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide

2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide (PubChem CID 82057064) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide
PubChem CID82057064
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide
SMILESNc1cc(C=O)ccc1OCC(=O)NC1CCCC1
InChIInChI=1S/C14H18N2O3/c15-12-7-10(8-17)5-6-13(12)19-9-14(18)16-11-3-1-2-4-11/h5-8,11H,1-4,9,15H2,(H,16,18)
InChIKeyJWZUYTNUNVTFGQ-UHFFFAOYSA-N
XLogP1.52
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-amino-4-bromophenoxy)-N-cycloheptylacetamide
CID 65430153
2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide
CID 55068862
N-cyclopentyl-2-(2-formyl-4-methylphenoxy)acetamide
CID 63324573
2-(2-amino-4-formylphenoxy)-N-(2-methoxyethyl)acetamide
CID 82057058
N-cyclohexyl-2-(4-formylphenyl)acetamide
CID 142533026
N-cyclopentyl-2-(4-fluoro-2-sulfamoylphenoxy)acetamide
CID 82916135
2-(4-bromo-2-sulfamoylphenoxy)-N-cyclopentylacetamide
CID 82916266
N-cyclopropyl-2-(4-formyl-2,6-dimethylphenoxy)acetamide
CID 26054636
2-[4-[(carbamoylhydrazinylidene)methyl]-2-methoxyphenoxy]-N-cyclohexylacetamide
CID 168533377
3-chloro-4-[2-(cyclobutylamino)-2-oxoethoxy]benzoic acid
CID 146171644
N-cyclopentyl-2-[(6-formyl-3-pyridinyl)oxy]acetamide
CID 79793955
3-amino-N-cyclopentyl-4-(2,2,2-trifluoroethoxy)benzamide
CID 171933201

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide?
The IUPAC name of 2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide (CID 82057064) is 2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide.
What is the SMILES notation for 2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide?
The canonical SMILES for 2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide is Nc1cc(C=O)ccc1OCC(=O)NC1CCCC1.
What is the InChIKey of 2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide?
The InChIKey is JWZUYTNUNVTFGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c15-12-7-10(8-17)5-6-13(12)19-9-14(18)16-11-3-1-2-4-11/h5-8,11H,1-4,9,15H2,(H,16,18).
What are the key properties of 2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide?
2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide has a molecular weight of 262.31 g/mol, XLogP of 1.52, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4-formylphenoxy)-N-cyclopentylacetamide is sourced from PubChem (CID 82057064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).