2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one

C14H19NO2 — CID 82290159

IUPAC2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one
SMILESCC(N)C(=O)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C14H19NO2/c1-10(15)14(16)11-6-8-13(9-7-11)17-12-4-2-3-5-12/h6-10,12H,2-5,15H2,1H3
InChIKeyQKZKOFODMFHDFJ-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.54
Rot. Bonds4

About 2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one

2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one (PubChem CID 82290159) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one.

Molecular Properties

Compound Name2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one
PubChem CID82290159
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one
SMILESCC(N)C(=O)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C14H19NO2/c1-10(15)14(16)11-6-8-13(9-7-11)17-12-4-2-3-5-12/h6-10,12H,2-5,15H2,1H3
InChIKeyQKZKOFODMFHDFJ-UHFFFAOYSA-N
XLogP2.54
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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2-amino-N-(3-cyclopentyloxyphenyl)propanamide
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1-cyclopentyloxy-4-propan-2-ylbenzene
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bromo 4-cyclobutyloxybenzoate
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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one?
The IUPAC name of 2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one (CID 82290159) is 2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one.
What is the SMILES notation for 2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one?
The canonical SMILES for 2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one is CC(N)C(=O)c1ccc(OC2CCCC2)cc1.
What is the InChIKey of 2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one?
The InChIKey is QKZKOFODMFHDFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-10(15)14(16)11-6-8-13(9-7-11)17-12-4-2-3-5-12/h6-10,12H,2-5,15H2,1H3.
What are the key properties of 2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one?
2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one has a molecular weight of 233.31 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(4-cyclopentyloxyphenyl)propan-1-one is sourced from PubChem (CID 82290159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).