ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate

C16H24N2O4 — CID 112502614

IUPACethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate
SMILESCCOC(=O)NCC(c1ccc(OC)cc1)N1CCOCC1
InChIInChI=1S/C16H24N2O4/c1-3-22-16(19)17-12-15(18-8-10-21-11-9-18)13-4-6-14(20-2)7-5-13/h4-7,15H,3,8-12H2,1-2H3,(H,17,19)
InChIKeyZGHZHSXHAQBVNW-UHFFFAOYSA-N
MW308.38 g/mol
LogP1.81
Rot. Bonds6

About ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate

ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate (PubChem CID 112502614) has the molecular formula C16H24N2O4 and a molecular weight of 308.38 g/mol. Its IUPAC name is ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate
PubChem CID112502614
Molecular FormulaC16H24N2O4
Molecular Weight308.38 g/mol
Exact Mass308.17
IUPAC Nameethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate
SMILESCCOC(=O)NCC(c1ccc(OC)cc1)N1CCOCC1
InChIInChI=1S/C16H24N2O4/c1-3-22-16(19)17-12-15(18-8-10-21-11-9-18)13-4-6-14(20-2)7-5-13/h4-7,15H,3,8-12H2,1-2H3,(H,17,19)
InChIKeyZGHZHSXHAQBVNW-UHFFFAOYSA-N
XLogP1.81
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl N-[1-[[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]amino]-3-methyl-1-oxobutan-2-yl]carbamate
CID 55648266
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]propanamide
CID 43006637
4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 31460518
4-methoxy-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 17011129
2-amino-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2-methylpropanamide;dihydrochloride
CID 119829745
N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2,2-diphenylacetamide
CID 2467575
3-(4-methoxyphenyl)-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]propanamide
CID 44892273
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2,5-dimethylfuran-3-carboxamide
CID 2998590
2-(4-aminophenyl)-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide;dihydrochloride
CID 119829747
ethyl 1-[N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-N'-methylcarbamimidoyl]piperidine-4-carboxylate;hydroiodide
CID 111155235
N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-4-methoxybenzamide
CID 30834690
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]cyclohexanecarboxamide
CID 16811484

Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate?
The IUPAC name of ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate (CID 112502614) is ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate.
What is the SMILES notation for ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate?
The canonical SMILES for ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate is CCOC(=O)NCC(c1ccc(OC)cc1)N1CCOCC1.
What is the InChIKey of ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate?
The InChIKey is ZGHZHSXHAQBVNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O4/c1-3-22-16(19)17-12-15(18-8-10-21-11-9-18)13-4-6-14(20-2)7-5-13/h4-7,15H,3,8-12H2,1-2H3,(H,17,19).
What are the key properties of ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate?
ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate has a molecular weight of 308.38 g/mol, XLogP of 1.81, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate is sourced from PubChem (CID 112502614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).