N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide

C15H20N2O4 — CID 100737212

IUPACN-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide
SMILESCOc1ccccc1CCNC(=O)CN1CCOCC1=O
InChIInChI=1S/C15H20N2O4/c1-20-13-5-3-2-4-12(13)6-7-16-14(18)10-17-8-9-21-11-15(17)19/h2-5H,6-11H2,1H3,(H,16,18)
InChIKeyXRCREOAONXXHAD-UHFFFAOYSA-N
MW292.33 g/mol
LogP0.21
Rot. Bonds6

About N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide

N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide (PubChem CID 100737212) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide.

Molecular Properties

Compound NameN-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide
PubChem CID100737212
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC NameN-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide
SMILESCOc1ccccc1CCNC(=O)CN1CCOCC1=O
InChIInChI=1S/C15H20N2O4/c1-20-13-5-3-2-4-12(13)6-7-16-14(18)10-17-8-9-21-11-15(17)19/h2-5H,6-11H2,1H3,(H,16,18)
InChIKeyXRCREOAONXXHAD-UHFFFAOYSA-N
XLogP0.21
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-dioxoimidazolidin-1-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 110686709
2-(2,5-dimethylpyrrol-1-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 110688799
N-[2-(2-methoxyphenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide
CID 134055335
N-[(2-methoxyphenyl)methyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
CID 110686502
1-[2-(2-methoxyphenyl)ethyl]-3-(2-morpholin-4-ylethyl)urea
CID 110408119
2-[(2S)-2',4-dioxospiro[1,3-dihydroquinazoline-2,5'-azepane]-1'-yl]-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 95792986
methyl 1-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl]piperidine-4-carboxylate
CID 8754699
N-[2-(2-methoxyphenyl)ethyl]-2-methylsulfanylacetamide
CID 112766496
formic acid;N-[2-(2-methoxyphenyl)ethyl]-2-(1-methyl-9-oxa-1,4-diazaspiro[5.5]undecan-4-yl)acetamide
CID 154919774
N-[2-(2-methoxyphenyl)ethyl]-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]acetamide
CID 30672521
N-[2-(2-methoxyphenyl)ethyl]-3,3-dimethylmorpholine-4-carboxamide
CID 110421778
2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 113219093

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide?
The IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide (CID 100737212) is N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide.
What is the SMILES notation for N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide?
The canonical SMILES for N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide is COc1ccccc1CCNC(=O)CN1CCOCC1=O.
What is the InChIKey of N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide?
The InChIKey is XRCREOAONXXHAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-20-13-5-3-2-4-12(13)6-7-16-14(18)10-17-8-9-21-11-15(17)19/h2-5H,6-11H2,1H3,(H,16,18).
What are the key properties of N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide?
N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide has a molecular weight of 292.33 g/mol, XLogP of 0.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide is sourced from PubChem (CID 100737212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).