2-amino-1-(4-phenylmethoxyphenyl)ethanone

C15H15NO2 — CID 14579463

IUPAC2-amino-1-(4-phenylmethoxyphenyl)ethanone
SMILESNCC(=O)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C15H15NO2/c16-10-15(17)13-6-8-14(9-7-13)18-11-12-4-2-1-3-5-12/h1-9H,10-11,16H2
InChIKeyYHJKYNMAHQSKPP-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.41
Rot. Bonds5

About 2-amino-1-(4-phenylmethoxyphenyl)ethanone

2-amino-1-(4-phenylmethoxyphenyl)ethanone (PubChem CID 14579463) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-amino-1-(4-phenylmethoxyphenyl)ethanone.

Molecular Properties

Compound Name2-amino-1-(4-phenylmethoxyphenyl)ethanone
PubChem CID14579463
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Name2-amino-1-(4-phenylmethoxyphenyl)ethanone
SMILESNCC(=O)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C15H15NO2/c16-10-15(17)13-6-8-14(9-7-13)18-11-12-4-2-1-3-5-12/h1-9H,10-11,16H2
InChIKeyYHJKYNMAHQSKPP-UHFFFAOYSA-N
XLogP2.41
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

benzyl 2-[4-(2-aminoacetyl)phenoxy]acetate
CID 67246007
2-chloro-1-(4-phenylmethoxyphenyl)ethanone
CID 14579462
4-phenylmethoxybenzoic acid
CID 68896574
2-amino-1-(3-phenylmethoxyphenyl)ethanone;hydrochloride
CID 71464250
4-phenylmethoxybenzoyl fluoride
CID 154719359
4-(4-phenylmethoxybenzoyl)benzoic acid
CID 11616925
2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone
CID 18923783
N-(2-aminoethyl)-4-phenylmethoxybenzamide
CID 13064036
2-amino-1-(4-methyl-3-phenylmethoxyphenyl)ethanone
CID 117391400
(2-amino-2-oxoethyl) 4-phenylmethoxybenzoate
CID 2607609
2-azido-1-(4-phenylmethoxyphenyl)ethanone
CID 71416333
[2-oxo-2-(4-phenylmethoxyphenyl)ethyl] 2-hydroxy-2,2-diphenylacetate
CID 4269875

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(4-phenylmethoxyphenyl)ethanone?
The IUPAC name of 2-amino-1-(4-phenylmethoxyphenyl)ethanone (CID 14579463) is 2-amino-1-(4-phenylmethoxyphenyl)ethanone.
What is the SMILES notation for 2-amino-1-(4-phenylmethoxyphenyl)ethanone?
The canonical SMILES for 2-amino-1-(4-phenylmethoxyphenyl)ethanone is NCC(=O)c1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 2-amino-1-(4-phenylmethoxyphenyl)ethanone?
The InChIKey is YHJKYNMAHQSKPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c16-10-15(17)13-6-8-14(9-7-13)18-11-12-4-2-1-3-5-12/h1-9H,10-11,16H2.
What are the key properties of 2-amino-1-(4-phenylmethoxyphenyl)ethanone?
2-amino-1-(4-phenylmethoxyphenyl)ethanone has a molecular weight of 241.29 g/mol, XLogP of 2.41, 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-phenylmethoxyphenyl)ethanone is sourced from PubChem (CID 14579463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).