N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide

C15H22N2O2 — CID 106200082

IUPACN-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide
SMILESCC(OCCC1CCC1)C(=O)Nc1ccc(N)cc1
InChIInChI=1S/C15H22N2O2/c1-11(19-10-9-12-3-2-4-12)15(18)17-14-7-5-13(16)6-8-14/h5-8,11-12H,2-4,9-10,16H2,1H3,(H,17,18)
InChIKeyFGPIWUGAUVTBHG-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.80
Rot. Bonds6

About N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide

N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide (PubChem CID 106200082) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide
PubChem CID106200082
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide
SMILESCC(OCCC1CCC1)C(=O)Nc1ccc(N)cc1
InChIInChI=1S/C15H22N2O2/c1-11(19-10-9-12-3-2-4-12)15(18)17-14-7-5-13(16)6-8-14/h5-8,11-12H,2-4,9-10,16H2,1H3,(H,17,18)
InChIKeyFGPIWUGAUVTBHG-UHFFFAOYSA-N
XLogP2.80
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.80
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

N-(4-aminophenyl)-2-(2-phenylethoxy)propanamide
CID 43127256
N-(4-aminophenyl)-4-(2-cyclobutylethoxy)butanamide
CID 106200083
N-(4-amino-2-chlorophenyl)-2-(cyclohexylmethoxy)propanamide
CID 62382552
N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
CID 66323873
(2S)-N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)propanamide
CID 99776072
N-(3-aminophenyl)-2-(3,3,3-trifluoropropoxy)propanamide
CID 82954605
N-(4-cyclopentylsulfonylphenyl)-2-(cyclopropylmethoxy)propanamide
CID 86847260
N-(4-aminophenyl)-2-[cyclopropyl(2-methoxyethyl)amino]propanamide
CID 61450272
4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide
CID 47422905
N-(4-aminophenyl)-2,3,3-trimethylbutanamide
CID 89148503
2-cyclohexylethyl 4-aminobenzoate
CID 114192361
(2R)-N-(4-aminophenyl)-2-fluoropropanamide
CID 131168097

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide?
The IUPAC name of N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide (CID 106200082) is N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide.
What is the SMILES notation for N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide?
The canonical SMILES for N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide is CC(OCCC1CCC1)C(=O)Nc1ccc(N)cc1.
What is the InChIKey of N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide?
The InChIKey is FGPIWUGAUVTBHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11(19-10-9-12-3-2-4-12)15(18)17-14-7-5-13(16)6-8-14/h5-8,11-12H,2-4,9-10,16H2,1H3,(H,17,18).
What are the key properties of N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide?
N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide has a molecular weight of 262.35 g/mol, XLogP of 2.80, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-2-(2-cyclobutylethoxy)propanamide is sourced from PubChem (CID 106200082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).