2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid

C10H17N3O5 — CID 83103608

IUPAC2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid
SMILESCCNC(=O)C1COCCN1C(=O)NCC(=O)O
InChIInChI=1S/C10H17N3O5/c1-2-11-9(16)7-6-18-4-3-13(7)10(17)12-5-8(14)15/h7H,2-6H2,1H3,(H,11,16)(H,12,17)(H,14,15)
InChIKeyUICRNUQENMKEER-UHFFFAOYSA-N
MW259.26 g/mol
LogP-1.38
Rot. Bonds4

About 2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid

2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid (PubChem CID 83103608) has the molecular formula C10H17N3O5 and a molecular weight of 259.26 g/mol. Its IUPAC name is 2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid
PubChem CID83103608
Molecular FormulaC10H17N3O5
Molecular Weight259.26 g/mol
Exact Mass259.12
IUPAC Name2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid
SMILESCCNC(=O)C1COCCN1C(=O)NCC(=O)O
InChIInChI=1S/C10H17N3O5/c1-2-11-9(16)7-6-18-4-3-13(7)10(17)12-5-8(14)15/h7H,2-6H2,1H3,(H,11,16)(H,12,17)(H,14,15)
InChIKeyUICRNUQENMKEER-UHFFFAOYSA-N
XLogP-1.38
TPSA107.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.26
LogP ≤ 5-1.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide
CID 116657396
2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]butanoic acid
CID 83103752
4-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]-2-hydroxybutanoic acid
CID 107840814
3-N-ethylmorpholine-3,4-dicarboxamide
CID 83106248
3-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]-2-methoxypropanoic acid
CID 106110427
2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]-methylamino]acetic acid
CID 83103394
4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide
CID 116657394
methyl 3-(ethylcarbamoyl)morpholine-4-carboxylate
CID 116657408
4-[2-(cyclopropylamino)acetyl]-N-ethylmorpholine-3-carboxamide
CID 83099136
2-[[4-(3,3-dimethylbutanoyl)morpholine-3-carbonyl]amino]acetic acid
CID 167854126
2-[cyclopropyl-[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid
CID 83104272
2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]pent-4-enoic acid
CID 83104278

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid?
The IUPAC name of 2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid (CID 83103608) is 2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid.
What is the SMILES notation for 2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid?
The canonical SMILES for 2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid is CCNC(=O)C1COCCN1C(=O)NCC(=O)O.
What is the InChIKey of 2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid?
The InChIKey is UICRNUQENMKEER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O5/c1-2-11-9(16)7-6-18-4-3-13(7)10(17)12-5-8(14)15/h7H,2-6H2,1H3,(H,11,16)(H,12,17)(H,14,15).
What are the key properties of 2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid?
2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid has a molecular weight of 259.26 g/mol, XLogP of -1.38, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid is sourced from PubChem (CID 83103608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).