2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone

C11H15NO2 — CID 102543509

IUPAC2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone
SMILESCOCCc1ccc(C(=O)CN)cc1
InChIInChI=1S/C11H15NO2/c1-14-7-6-9-2-4-10(5-3-9)11(13)8-12/h2-5H,6-8,12H2,1H3
InChIKeyOVKUBFUJRDHISP-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.02
Rot. Bonds5

About 2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone

2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone (PubChem CID 102543509) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone.

Molecular Properties

Compound Name2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone
PubChem CID102543509
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone
SMILESCOCCc1ccc(C(=O)CN)cc1
InChIInChI=1S/C11H15NO2/c1-14-7-6-9-2-4-10(5-3-9)11(13)8-12/h2-5H,6-8,12H2,1H3
InChIKeyOVKUBFUJRDHISP-UHFFFAOYSA-N
XLogP1.02
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone?
The IUPAC name of 2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone (CID 102543509) is 2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone.
What is the SMILES notation for 2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone?
The canonical SMILES for 2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone is COCCc1ccc(C(=O)CN)cc1.
What is the InChIKey of 2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone?
The InChIKey is OVKUBFUJRDHISP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-14-7-6-9-2-4-10(5-3-9)11(13)8-12/h2-5H,6-8,12H2,1H3.
What are the key properties of 2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone?
2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone has a molecular weight of 193.25 g/mol, XLogP of 1.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-[4-(2-methoxyethyl)phenyl]ethanone is sourced from PubChem (CID 102543509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).