2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone

C15H22N2O4 — CID 60905328

IUPAC2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone
SMILESCOc1cccc(CCN)c1OCC(=O)N1CCOCC1
InChIInChI=1S/C15H22N2O4/c1-19-13-4-2-3-12(5-6-16)15(13)21-11-14(18)17-7-9-20-10-8-17/h2-4H,5-11,16H2,1H3
InChIKeyMFTJKGFFBPBTOS-UHFFFAOYSA-N
MW294.35 g/mol
LogP0.43
Rot. Bonds6

About 2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone

2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone (PubChem CID 60905328) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is 2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone
PubChem CID60905328
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Name2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone
SMILESCOc1cccc(CCN)c1OCC(=O)N1CCOCC1
InChIInChI=1S/C15H22N2O4/c1-19-13-4-2-3-12(5-6-16)15(13)21-11-14(18)17-7-9-20-10-8-17/h2-4H,5-11,16H2,1H3
InChIKeyMFTJKGFFBPBTOS-UHFFFAOYSA-N
XLogP0.43
TPSA74.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2,3-dimethoxyphenyl)methyl 3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoate
CID 24980785
2-[2-(2-aminoethyl)-6-bromophenoxy]-1-pyrrolidin-1-ylethanone
CID 61391986
2-(2-methoxyphenoxy)-1-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]ethanone
CID 113073699
2-[2-fluoro-6-(methylaminomethyl)phenoxy]-1-morpholin-4-ylethanone
CID 115952550
2-[2-(aminomethyl)-3-fluorophenoxy]-1-morpholin-4-ylethanone
CID 43609224
2-[2-(2-aminoethyl)-6-bromophenoxy]-1-(azepan-1-yl)ethanone
CID 61391992
2-[2-(aminomethyl)phenoxy]-1-(1,4-oxazepan-4-yl)ethanone
CID 55154462
1-morpholin-4-yl-2-naphthalen-1-yloxyethanone
CID 954548
(2-morpholin-4-yl-2-oxoethyl) (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate
CID 2587163
2-[2-chloro-6-(hydroxymethyl)phenoxy]-1-morpholin-4-ylethanone
CID 112612580
3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoic acid
CID 2363825
2-[2-methyl-6-(methylaminomethyl)phenoxy]-1-morpholin-4-ylethanone
CID 115952262

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone (CID 60905328) is 2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone is COc1cccc(CCN)c1OCC(=O)N1CCOCC1.
What is the InChIKey of 2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone?
The InChIKey is MFTJKGFFBPBTOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-19-13-4-2-3-12(5-6-16)15(13)21-11-14(18)17-7-9-20-10-8-17/h2-4H,5-11,16H2,1H3.
What are the key properties of 2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone?
2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone has a molecular weight of 294.35 g/mol, XLogP of 0.43, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminoethyl)-6-methoxyphenoxy]-1-morpholin-4-ylethanone is sourced from PubChem (CID 60905328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).