2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid

C11H17N3O5 — CID 83095825

IUPAC2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid
SMILESNC(=O)C1COCCN1C(=O)N(CC(=O)O)C1CC1
InChIInChI=1S/C11H17N3O5/c12-10(17)8-6-19-4-3-13(8)11(18)14(5-9(15)16)7-1-2-7/h7-8H,1-6H2,(H2,12,17)(H,15,16)
InChIKeyXFXAEHQLBMUCKI-UHFFFAOYSA-N
MW271.27 g/mol
LogP-1.16
Rot. Bonds4

About 2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid

2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid (PubChem CID 83095825) has the molecular formula C11H17N3O5 and a molecular weight of 271.27 g/mol. Its IUPAC name is 2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid.

Molecular Properties

Compound Name2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid
PubChem CID83095825
Molecular FormulaC11H17N3O5
Molecular Weight271.27 g/mol
Exact Mass271.12
IUPAC Name2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid
SMILESNC(=O)C1COCCN1C(=O)N(CC(=O)O)C1CC1
InChIInChI=1S/C11H17N3O5/c12-10(17)8-6-19-4-3-13(8)11(18)14(5-9(15)16)7-1-2-7/h7-8H,1-6H2,(H2,12,17)(H,15,16)
InChIKeyXFXAEHQLBMUCKI-UHFFFAOYSA-N
XLogP-1.16
TPSA113.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 5-1.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[cyclopropyl-[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid
CID 83104272
2-[(3-carbamoylmorpholine-4-carbonyl)-prop-2-ynylamino]acetic acid
CID 83095821
3-[(3-carbamoylmorpholine-4-carbonyl)-ethylamino]butanoic acid
CID 83095443
3-[cyclopropyl-[3-(methylcarbamoyl)morpholine-4-carbonyl]amino]propanoic acid
CID 83104295
2-[1-(3-carbamoylmorpholine-4-carbonyl)piperidin-4-yl]acetic acid
CID 83098734
2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]-methylamino]acetic acid
CID 83103394
4-(2-aminopropanoyl)morpholine-3-carboxamide
CID 83101341
2-[1-(3-carbamoylmorpholine-4-carbonyl)pyrrolidin-3-yl]acetic acid
CID 83095359
4-(3-amino-3-sulfanylidenepropanoyl)morpholine-3-carboxamide
CID 83101281
2-[(2-carbamoylpiperidine-1-carbonyl)-(carboxymethyl)amino]acetic acid
CID 63645478
4-(2-amino-2-ethylbutanoyl)morpholine-3-carboxamide
CID 83101952
4-(4-aminopentanoyl)morpholine-3-carboxamide
CID 83100902

Frequently Asked Questions

What is the IUPAC name of 2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid?
The IUPAC name of 2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid (CID 83095825) is 2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid.
What is the SMILES notation for 2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid?
The canonical SMILES for 2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid is NC(=O)C1COCCN1C(=O)N(CC(=O)O)C1CC1.
What is the InChIKey of 2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid?
The InChIKey is XFXAEHQLBMUCKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O5/c12-10(17)8-6-19-4-3-13(8)11(18)14(5-9(15)16)7-1-2-7/h7-8H,1-6H2,(H2,12,17)(H,15,16).
What are the key properties of 2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid?
2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid has a molecular weight of 271.27 g/mol, XLogP of -1.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-carbamoylmorpholine-4-carbonyl)-cyclopropylamino]acetic acid is sourced from PubChem (CID 83095825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).