N-(4-aminophenyl)-2-cyclopentyloxyacetamide

C13H18N2O2 — CID 16783535

IUPACN-(4-aminophenyl)-2-cyclopentyloxyacetamide
SMILESNc1ccc(NC(=O)COC2CCCC2)cc1
InChIInChI=1S/C13H18N2O2/c14-10-5-7-11(8-6-10)15-13(16)9-17-12-3-1-2-4-12/h5-8,12H,1-4,9,14H2,(H,15,16)
InChIKeyCZFPRMUNWQBVFA-UHFFFAOYSA-N
MW234.30 g/mol
LogP2.17
Rot. Bonds4

About N-(4-aminophenyl)-2-cyclopentyloxyacetamide

N-(4-aminophenyl)-2-cyclopentyloxyacetamide (PubChem CID 16783535) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-(4-aminophenyl)-2-cyclopentyloxyacetamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-2-cyclopentyloxyacetamide
PubChem CID16783535
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-(4-aminophenyl)-2-cyclopentyloxyacetamide
SMILESNc1ccc(NC(=O)COC2CCCC2)cc1
InChIInChI=1S/C13H18N2O2/c14-10-5-7-11(8-6-10)15-13(16)9-17-12-3-1-2-4-12/h5-8,12H,1-4,9,14H2,(H,15,16)
InChIKeyCZFPRMUNWQBVFA-UHFFFAOYSA-N
XLogP2.17
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 52.17
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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Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-2-cyclopentyloxyacetamide?
The IUPAC name of N-(4-aminophenyl)-2-cyclopentyloxyacetamide (CID 16783535) is N-(4-aminophenyl)-2-cyclopentyloxyacetamide.
What is the SMILES notation for N-(4-aminophenyl)-2-cyclopentyloxyacetamide?
The canonical SMILES for N-(4-aminophenyl)-2-cyclopentyloxyacetamide is Nc1ccc(NC(=O)COC2CCCC2)cc1.
What is the InChIKey of N-(4-aminophenyl)-2-cyclopentyloxyacetamide?
The InChIKey is CZFPRMUNWQBVFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c14-10-5-7-11(8-6-10)15-13(16)9-17-12-3-1-2-4-12/h5-8,12H,1-4,9,14H2,(H,15,16).
What are the key properties of N-(4-aminophenyl)-2-cyclopentyloxyacetamide?
N-(4-aminophenyl)-2-cyclopentyloxyacetamide has a molecular weight of 234.30 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-2-cyclopentyloxyacetamide is sourced from PubChem (CID 16783535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).