3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide

C15H22N2O3 — CID 65103822

IUPAC3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide
SMILESNc1ccccc1OCCC(=O)NCC1(O)CCCC1
InChIInChI=1S/C15H22N2O3/c16-12-5-1-2-6-13(12)20-10-7-14(18)17-11-15(19)8-3-4-9-15/h1-2,5-6,19H,3-4,7-11,16H2,(H,17,18)
InChIKeyBLYOMONKCHZQOD-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.46
Rot. Bonds6

About 3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide

3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide (PubChem CID 65103822) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide.

Molecular Properties

Compound Name3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide
PubChem CID65103822
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide
SMILESNc1ccccc1OCCC(=O)NCC1(O)CCCC1
InChIInChI=1S/C15H22N2O3/c16-12-5-1-2-6-13(12)20-10-7-14(18)17-11-15(19)8-3-4-9-15/h1-2,5-6,19H,3-4,7-11,16H2,(H,17,18)
InChIKeyBLYOMONKCHZQOD-UHFFFAOYSA-N
XLogP1.46
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-2-oxoethyl)-3-(2-aminophenoxy)propanamide
CID 61091283
3-(2-aminophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]propanamide
CID 62523597
3-(2-aminophenoxy)-N-(2-pyrrolidin-1-ylethyl)propanamide
CID 62636073
3-(2-aminophenoxy)propanamide
CID 39869131
3-(2-aminophenoxy)-N-cyclohexylpropanamide
CID 54915855
methyl 3-[3-(2-aminophenoxy)propanoylamino]propanoate
CID 61104247
N-[(1-hydroxycyclohexyl)methyl]-2-(2-methylphenoxy)acetamide
CID 64868951
N-[(1-hydroxycyclobutyl)methyl]-3-(2,3,5-trimethylphenoxy)propanamide
CID 111539630
3-(2-aminophenoxy)-N-pentylpropanamide
CID 61090081
1-[(1-hydroxycyclopentyl)methyl]-3-(2-propoxyphenyl)urea
CID 111103515
N-[(1-hydroxycycloheptyl)methyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 86974243
3-(3,4-dimethylphenoxy)-N-[(1-hydroxycyclobutyl)methyl]propanamide
CID 111539418

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide?
The IUPAC name of 3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide (CID 65103822) is 3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide.
What is the SMILES notation for 3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide?
The canonical SMILES for 3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide is Nc1ccccc1OCCC(=O)NCC1(O)CCCC1.
What is the InChIKey of 3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide?
The InChIKey is BLYOMONKCHZQOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c16-12-5-1-2-6-13(12)20-10-7-14(18)17-11-15(19)8-3-4-9-15/h1-2,5-6,19H,3-4,7-11,16H2,(H,17,18).
What are the key properties of 3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide?
3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide has a molecular weight of 278.35 g/mol, XLogP of 1.46, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]propanamide is sourced from PubChem (CID 65103822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).