N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide

C13H23N3O4 — CID 120933214

IUPACN-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide
SMILESCC(=O)NCC1CN(C(=O)[C@H]2NCCO[C@@H]2C)CCO1
InChIInChI=1S/C13H23N3O4/c1-9-12(14-3-5-19-9)13(18)16-4-6-20-11(8-16)7-15-10(2)17/h9,11-12,14H,3-8H2,1-2H3,(H,15,17)/t9-,11?,12+/m1/s1
InChIKeyWUXQCVZSBAAEOU-DGHCKJRHSA-N
MW285.34 g/mol
LogP-1.27
Rot. Bonds3

About N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide

N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide (PubChem CID 120933214) has the molecular formula C13H23N3O4 and a molecular weight of 285.34 g/mol. Its IUPAC name is N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide
PubChem CID120933214
Molecular FormulaC13H23N3O4
Molecular Weight285.34 g/mol
Exact Mass285.17
IUPAC NameN-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide
SMILESCC(=O)NCC1CN(C(=O)[C@H]2NCCO[C@@H]2C)CCO1
InChIInChI=1S/C13H23N3O4/c1-9-12(14-3-5-19-9)13(18)16-4-6-20-11(8-16)7-15-10(2)17/h9,11-12,14H,3-8H2,1-2H3,(H,15,17)/t9-,11?,12+/m1/s1
InChIKeyWUXQCVZSBAAEOU-DGHCKJRHSA-N
XLogP-1.27
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 5-1.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide with MolForge

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Related Compounds

[2-(hydroxymethyl)morpholin-4-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone;hydrochloride
CID 120932154
1-[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperazin-1-yl]ethanone
CID 120916623
[(2R,3S)-2-methylmorpholin-3-yl]-(2-methyl-1,4-oxazepan-4-yl)methanone;hydrochloride
CID 120930831
N-[[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]methyl]butanamide
CID 120929380
N-[[(2S)-4-methylmorpholin-2-yl]methyl]acetamide
CID 170608678
N-[(4-methylmorpholin-2-yl)methyl]acetamide
CID 69087754
N-[[4-(2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)morpholin-2-yl]methyl]acetamide;hydrochloride
CID 119326650
[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone
CID 120932585
(3,3-dimethylpyrrolidin-1-yl)-[(2R,3S)-2-methylmorpholin-3-yl]methanone
CID 120932229
N-[[4-[3-(4-fluorophenyl)-2-methylprop-2-enoyl]morpholin-2-yl]methyl]acetamide
CID 91943104
[4-(cyclopropylmethoxy)piperidin-1-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone
CID 120935599
[(2R,3S)-2-methylmorpholin-3-yl]-[3-(2-methylpropyl)pyrrolidin-1-yl]methanone;hydrochloride
CID 120932218

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide?
The IUPAC name of N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide (CID 120933214) is N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide.
What is the SMILES notation for N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide?
The canonical SMILES for N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide is CC(=O)NCC1CN(C(=O)[C@H]2NCCO[C@@H]2C)CCO1.
What is the InChIKey of N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide?
The InChIKey is WUXQCVZSBAAEOU-DGHCKJRHSA-N. The full InChI is InChI=1S/C13H23N3O4/c1-9-12(14-3-5-19-9)13(18)16-4-6-20-11(8-16)7-15-10(2)17/h9,11-12,14H,3-8H2,1-2H3,(H,15,17)/t9-,11?,12+/m1/s1.
What are the key properties of N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide?
N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide has a molecular weight of 285.34 g/mol, XLogP of -1.27, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(2R,3S)-2-methylmorpholine-3-carbonyl]morpholin-2-yl]methyl]acetamide is sourced from PubChem (CID 120933214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).