N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate

C14H20N2O5 — CID 139069446

IUPACN-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate
SMILESCC(=O)Nc1ccc(OCC(=O)N2CCOCC2)cc1.O
InChIInChI=1S/C14H18N2O4.H2O/c1-11(17)15-12-2-4-13(5-3-12)20-10-14(18)16-6-8-19-9-7-16;/h2-5H,6-10H2,1H3,(H,15,17);1H2
InChIKeyWGHFTQRCSGQMLA-UHFFFAOYSA-N
MW296.32 g/mol
LogP0.06
Rot. Bonds4

About N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate

N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate (PubChem CID 139069446) has the molecular formula C14H20N2O5 and a molecular weight of 296.32 g/mol. Its IUPAC name is N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate.

Molecular Properties

Compound NameN-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate
PubChem CID139069446
Molecular FormulaC14H20N2O5
Molecular Weight296.32 g/mol
Exact Mass296.14
IUPAC NameN-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate
SMILESCC(=O)Nc1ccc(OCC(=O)N2CCOCC2)cc1.O
InChIInChI=1S/C14H18N2O4.H2O/c1-11(17)15-12-2-4-13(5-3-12)20-10-14(18)16-6-8-19-9-7-16;/h2-5H,6-10H2,1H3,(H,15,17);1H2
InChIKeyWGHFTQRCSGQMLA-UHFFFAOYSA-N
XLogP0.06
TPSA99.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.32
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide
CID 7203468
methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate
CID 2923381
N-[4-[2-oxo-2-(4-oxopiperidin-1-yl)ethoxy]phenyl]acetamide
CID 62029121
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]benzamide
CID 9252709
2-(4-methylphenoxy)-1-morpholin-4-ylethanone
CID 674914
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]thiomorpholine-4-carboxamide
CID 118776743
N-[4-[2-(2-methylmorpholin-4-yl)-2-oxoethoxy]phenyl]acetamide
CID 51293775
2-(4-hydroxyphenoxy)-1-morpholin-4-ylethanone
CID 43143408
(2S)-2-methyl-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-1,4-oxazepane-4-carboxamide
CID 125155597
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-1,3-benzodioxole-5-carboxamide
CID 992710
4-(4-methoxyphenyl)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]oxane-4-carboxamide
CID 100687083
1-(2-methylpropanoyl)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]piperidine-4-carboxamide
CID 131904149

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate?
The IUPAC name of N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate (CID 139069446) is N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate.
What is the SMILES notation for N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate?
The canonical SMILES for N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate is CC(=O)Nc1ccc(OCC(=O)N2CCOCC2)cc1.O.
What is the InChIKey of N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate?
The InChIKey is WGHFTQRCSGQMLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4.H2O/c1-11(17)15-12-2-4-13(5-3-12)20-10-14(18)16-6-8-19-9-7-16;/h2-5H,6-10H2,1H3,(H,15,17);1H2.
What are the key properties of N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate?
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate has a molecular weight of 296.32 g/mol, XLogP of 0.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate is sourced from PubChem (CID 139069446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).