2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide

C15H21N3O3 — CID 61026518

IUPAC2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide
SMILESNc1ccc(OCC(=O)NC(=O)NC2CCCCC2)cc1
InChIInChI=1S/C15H21N3O3/c16-11-6-8-13(9-7-11)21-10-14(19)18-15(20)17-12-4-2-1-3-5-12/h6-9,12H,1-5,10,16H2,(H2,17,18,19,20)
InChIKeyUXWVVVYKXRCODJ-UHFFFAOYSA-N
MW291.35 g/mol
LogP1.81
Rot. Bonds4

About 2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide

2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide (PubChem CID 61026518) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide
PubChem CID61026518
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide
SMILESNc1ccc(OCC(=O)NC(=O)NC2CCCCC2)cc1
InChIInChI=1S/C15H21N3O3/c16-11-6-8-13(9-7-11)21-10-14(19)18-15(20)17-12-4-2-1-3-5-12/h6-9,12H,1-5,10,16H2,(H2,17,18,19,20)
InChIKeyUXWVVVYKXRCODJ-UHFFFAOYSA-N
XLogP1.81
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

2-(4-aminophenoxy)-N-(cyclopropylcarbamoyl)acetamide
CID 54908932
N-(cyclohexylcarbamoyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 7707104
N-(cyclohexylcarbamoyl)-2-(3,4-dimethylphenoxy)acetamide
CID 7610559
2-(4-aminophenyl)sulfanyl-N-(cyclopentylcarbamoyl)acetamide
CID 43299295
2-(4-aminophenoxy)-N-(1,1-dioxothian-4-yl)acetamide
CID 61102889
N-(cyclohexylcarbamoyl)-2-(3-ethylphenoxy)acetamide
CID 7642586
3-[[2-(4-aminophenoxy)acetyl]amino]-N-cyclopropylpropanamide
CID 79385591
2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide
CID 61466103
N-cyclododecyl-2-(4-methylphenoxy)acetamide
CID 2788426
2-(4-chlorophenoxy)-N-cyclooctylacetamide
CID 875180
N-cyclohexyl-2-(4-iodophenoxy)acetamide
CID 1313853
[2-(cyclohexylcarbamoylamino)-2-oxoethyl] 4-propoxybenzoate
CID 7211666

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide?
The IUPAC name of 2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide (CID 61026518) is 2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide.
What is the SMILES notation for 2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide?
The canonical SMILES for 2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide is Nc1ccc(OCC(=O)NC(=O)NC2CCCCC2)cc1.
What is the InChIKey of 2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide?
The InChIKey is UXWVVVYKXRCODJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c16-11-6-8-13(9-7-11)21-10-14(19)18-15(20)17-12-4-2-1-3-5-12/h6-9,12H,1-5,10,16H2,(H2,17,18,19,20).
What are the key properties of 2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide?
2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide has a molecular weight of 291.35 g/mol, XLogP of 1.81, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide is sourced from PubChem (CID 61026518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).