3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide

C16H22N2O5 — CID 41247421

IUPAC3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)N2CCO[C@H](C)C2)c1
InChIInChI=1S/C16H22N2O5/c1-11-10-18(4-5-23-11)15(19)9-17-16(20)12-6-13(21-2)8-14(7-12)22-3/h6-8,11H,4-5,9-10H2,1-3H3,(H,17,20)/t11-/m1/s1
InChIKeySTGRUXPZZBMZKG-LLVKDONJSA-N
MW322.36 g/mol
LogP0.68
Rot. Bonds5

About 3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide

3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide (PubChem CID 41247421) has the molecular formula C16H22N2O5 and a molecular weight of 322.36 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide
PubChem CID41247421
Molecular FormulaC16H22N2O5
Molecular Weight322.36 g/mol
Exact Mass322.15
IUPAC Name3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCC(=O)N2CCO[C@H](C)C2)c1
InChIInChI=1S/C16H22N2O5/c1-11-10-18(4-5-23-11)15(19)9-17-16(20)12-6-13(21-2)8-14(7-12)22-3/h6-8,11H,4-5,9-10H2,1-3H3,(H,17,20)/t11-/m1/s1
InChIKeySTGRUXPZZBMZKG-LLVKDONJSA-N
XLogP0.68
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3,5-dimethoxyphenyl)-[(2R)-2-methylmorpholin-4-yl]methanone
CID 51710349
4-methyl-N-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]benzamide
CID 46673862
3,4-dimethyl-N-[2-[(2S)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide
CID 42001425
N-[2-(azepan-1-yl)-2-oxoethyl]-3,5-dimethoxybenzamide
CID 26500774
(2S)-2-methyl-N-[(2,4,6-trimethoxyphenyl)methyl]morpholine-4-carboxamide
CID 95761707
3-methoxy-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]benzamide
CID 112995627
(3-methoxyphenyl)-[(2S)-2-methylmorpholin-4-yl]methanone
CID 51710348
(3,5-dimethoxyphenyl)-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 81208576
3,5-dimethoxy-N-[2-oxo-2-[4-[2-oxo-2-(propan-2-ylamino)ethyl]piperazin-1-yl]ethyl]benzamide
CID 18226344
N-[2-[4-(3,5-dimethoxybenzoyl)-1,4-diazepan-1-yl]-2-oxoethyl]benzamide
CID 108544969
2-(4-chloro-2-methoxy-5-methylanilino)-1-(2-methylmorpholin-4-yl)ethanone
CID 51111589
N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-3,5-dimethylbenzamide
CID 46652197

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide?
The IUPAC name of 3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide (CID 41247421) is 3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide?
The canonical SMILES for 3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide is COc1cc(OC)cc(C(=O)NCC(=O)N2CCO[C@H](C)C2)c1.
What is the InChIKey of 3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide?
The InChIKey is STGRUXPZZBMZKG-LLVKDONJSA-N. The full InChI is InChI=1S/C16H22N2O5/c1-11-10-18(4-5-23-11)15(19)9-17-16(20)12-6-13(21-2)8-14(7-12)22-3/h6-8,11H,4-5,9-10H2,1-3H3,(H,17,20)/t11-/m1/s1.
What are the key properties of 3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide?
3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide has a molecular weight of 322.36 g/mol, XLogP of 0.68, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[2-[(2R)-2-methylmorpholin-4-yl]-2-oxoethyl]benzamide is sourced from PubChem (CID 41247421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).