methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium

C16H23N4O4+ — CID 8693187

IUPACmethyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium
SMILESC[NH+](CC(=O)NC(=O)Nc1ccccc1)CC(=O)N1CCOCC1
InChIInChI=1S/C16H22N4O4/c1-19(12-15(22)20-7-9-24-10-8-20)11-14(21)18-16(23)17-13-5-3-2-4-6-13/h2-6H,7-12H2,1H3,(H2,17,18,21,23)/p+1
InChIKeyNUSXGTIWWHKOFP-UHFFFAOYSA-O
MW335.38 g/mol
LogP-1.29
Rot. Bonds5

About methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium

methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium (PubChem CID 8693187) has the molecular formula C16H23N4O4+ and a molecular weight of 335.38 g/mol. Its IUPAC name is methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium.

Molecular Properties

Compound Namemethyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium
PubChem CID8693187
Molecular FormulaC16H23N4O4+
Molecular Weight335.38 g/mol
Exact Mass335.17
IUPAC Namemethyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium
SMILESC[NH+](CC(=O)NC(=O)Nc1ccccc1)CC(=O)N1CCOCC1
InChIInChI=1S/C16H22N4O4/c1-19(12-15(22)20-7-9-24-10-8-20)11-14(21)18-16(23)17-13-5-3-2-4-6-13/h2-6H,7-12H2,1H3,(H2,17,18,21,23)/p+1
InChIKeyNUSXGTIWWHKOFP-UHFFFAOYSA-O
XLogP-1.29
TPSA92.18 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.38
LogP ≤ 5-1.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium with MolForge

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Related Compounds

methyl-[2-(4-methylanilino)-2-oxoethyl]-(2-morpholin-4-yl-2-oxoethyl)azanium
CID 8588773
[2-(tert-butylcarbamoylamino)-2-oxoethyl]-methyl-(2-morpholin-4-yl-2-oxoethyl)azanium
CID 8711610
methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]azanium
CID 8711428
4-morpholin-4-yl-4-oxo-N-phenylbutanamide
CID 9341047
(2-anilino-2-oxoethyl)-methyl-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]azanium
CID 8592839
[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxoethyl]-methyl-(2-morpholin-4-yl-2-oxoethyl)azanium
CID 8711764
[2-(3,5-dichloroanilino)-2-oxoethyl]-methyl-(2-morpholin-4-yl-2-oxoethyl)azanium
CID 8711406
[2-(4-ethoxycarbonylanilino)-2-oxoethyl]-methyl-(2-morpholin-4-yl-2-oxoethyl)azanium
CID 8711432
[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-methyl-(2-morpholin-4-yl-2-oxoethyl)azanium
CID 8711576
[2-(4-chloroanilino)-2-oxoethyl]-methyl-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]azanium
CID 9348099
2-[1-(2-morpholin-4-yl-2-oxoethyl)cyclopentyl]-N-phenylacetamide
CID 9391214
[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-methyl-(2-morpholin-4-yl-2-oxoethyl)azanium
CID 8711400

Frequently Asked Questions

What is the IUPAC name of methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium?
The IUPAC name of methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium (CID 8693187) is methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium.
What is the SMILES notation for methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium?
The canonical SMILES for methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium is C[NH+](CC(=O)NC(=O)Nc1ccccc1)CC(=O)N1CCOCC1.
What is the InChIKey of methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium?
The InChIKey is NUSXGTIWWHKOFP-UHFFFAOYSA-O. The full InChI is InChI=1S/C16H22N4O4/c1-19(12-15(22)20-7-9-24-10-8-20)11-14(21)18-16(23)17-13-5-3-2-4-6-13/h2-6H,7-12H2,1H3,(H2,17,18,21,23)/p+1.
What are the key properties of methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium?
methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium has a molecular weight of 335.38 g/mol, XLogP of -1.29, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-(2-morpholin-4-yl-2-oxoethyl)-[2-oxo-2-(phenylcarbamoylamino)ethyl]azanium is sourced from PubChem (CID 8693187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).