molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide

C9H19N3O4 — CID 153346596

IUPACmolecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide
SMILESNC(=O)CCNC(=O)CN1CCOCC1=O.[H][H].[H][H]
InChIInChI=1S/C9H15N3O4.2H2/c10-7(13)1-2-11-8(14)5-12-3-4-16-6-9(12)15;;/h1-6H2,(H2,10,13)(H,11,14);2*1H
InChIKeyCHJYZPNHWZSZIX-UHFFFAOYSA-N
MW233.27 g/mol
LogP-1.67
Rot. Bonds5

About molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide

molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide (PubChem CID 153346596) has the molecular formula C9H19N3O4 and a molecular weight of 233.27 g/mol. Its IUPAC name is molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide.

Molecular Properties

Compound Namemolecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide
PubChem CID153346596
Molecular FormulaC9H19N3O4
Molecular Weight233.27 g/mol
Exact Mass233.14
IUPAC Namemolecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide
SMILESNC(=O)CCNC(=O)CN1CCOCC1=O.[H][H].[H][H]
InChIInChI=1S/C9H15N3O4.2H2/c10-7(13)1-2-11-8(14)5-12-3-4-16-6-9(12)15;;/h1-6H2,(H2,10,13)(H,11,14);2*1H
InChIKeyCHJYZPNHWZSZIX-UHFFFAOYSA-N
XLogP-1.67
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 5-1.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one
CID 79468968
N-[2-(2-methoxyphenyl)ethyl]-2-(3-oxomorpholin-4-yl)acetamide
CID 100737212
3-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid
CID 43354693
ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one
CID 143371911
N,2,2-trimethyl-N'-[2-(3-oxomorpholin-4-yl)ethyl]butanediamide
CID 166506359
N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide
CID 110722581
4-[2-(1-methylpyrrol-3-yl)-2-oxoethyl]morpholin-3-one
CID 79467616
2-[[2-(2-oxoazepan-1-yl)acetyl]amino]acetamide
CID 15308077
3-(3-methylphenyl)-N-[2-(3-oxomorpholin-4-yl)ethyl]propanamide
CID 110722622
N-(4-aminophenyl)-N-methyl-2-(3-oxomorpholin-4-yl)acetamide
CID 79468372
2-(3-oxomorpholin-4-yl)ethanolate
CID 142382646
benzyl 2-(3-oxomorpholin-4-yl)acetate;2-(3-oxomorpholin-4-yl)acetic acid
CID 158991156

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide?
The IUPAC name of molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide (CID 153346596) is molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide.
What is the SMILES notation for molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide?
The canonical SMILES for molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide is NC(=O)CCNC(=O)CN1CCOCC1=O.[H][H].[H][H].
What is the InChIKey of molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide?
The InChIKey is CHJYZPNHWZSZIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O4.2H2/c10-7(13)1-2-11-8(14)5-12-3-4-16-6-9(12)15;;/h1-6H2,(H2,10,13)(H,11,14);2*1H.
What are the key properties of molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide?
molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide has a molecular weight of 233.27 g/mol, XLogP of -1.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide is sourced from PubChem (CID 153346596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).