3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid

C11H19N3O5 — CID 83026209

IUPAC3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid
SMILESCC(CC(=O)O)CC(=O)NC(=O)NN1CCOCC1
InChIInChI=1S/C11H19N3O5/c1-8(7-10(16)17)6-9(15)12-11(18)13-14-2-4-19-5-3-14/h8H,2-7H2,1H3,(H,16,17)(H2,12,13,15,18)
InChIKeyPCNUMIHUFHNTAY-UHFFFAOYSA-N
MW273.29 g/mol
LogP-0.44
Rot. Bonds5

About 3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid

3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid (PubChem CID 83026209) has the molecular formula C11H19N3O5 and a molecular weight of 273.29 g/mol. Its IUPAC name is 3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid.

Molecular Properties

Compound Name3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid
PubChem CID83026209
Molecular FormulaC11H19N3O5
Molecular Weight273.29 g/mol
Exact Mass273.13
IUPAC Name3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid
SMILESCC(CC(=O)O)CC(=O)NC(=O)NN1CCOCC1
InChIInChI=1S/C11H19N3O5/c1-8(7-10(16)17)6-9(15)12-11(18)13-14-2-4-19-5-3-14/h8H,2-7H2,1H3,(H,16,17)(H2,12,13,15,18)
InChIKeyPCNUMIHUFHNTAY-UHFFFAOYSA-N
XLogP-0.44
TPSA107.97 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 5-0.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic 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

3-methyl-5-[(4-methylpiperazin-1-yl)amino]-5-oxopentanoic acid
CID 83005393
5-[(3-ethylmorpholine-4-carbonyl)amino]-3-methyl-5-oxopentanoic acid
CID 62963970
N-morpholin-4-yl-2-(propan-2-ylamino)acetamide
CID 83016590
3-methyl-5-[[methyl(oxan-4-ylmethyl)carbamoyl]amino]-5-oxopentanoic acid
CID 63707561
7-(morpholin-4-ylcarbamoylamino)heptanoic acid
CID 83020507
3-methyl-5-oxo-5-[(2,2,3,3-tetramethylcyclopropyl)methylcarbamoylamino]pentanoic acid
CID 79360156
5-[(3-methoxyoxolan-3-yl)methylcarbamoylamino]-3-methyl-5-oxopentanoic acid
CID 104762334
(2R)-5-methoxy-2-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid
CID 107828725
3-methyl-5-[(4-methylpiperidine-1-carbonyl)amino]-5-oxopentanoic acid
CID 62942046
5-[(2-ethylmorpholine-4-carbonyl)amino]-3-methyl-5-oxopentanoic acid
CID 62965510
5-[(1,3-dimethylpiperidin-4-yl)carbamoylamino]-3-methyl-5-oxopentanoic acid
CID 114504596
5-[(1-ethylpyrrolidin-3-yl)methylcarbamoylamino]-3-methyl-5-oxopentanoic acid
CID 62964488

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid?
The IUPAC name of 3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid (CID 83026209) is 3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid.
What is the SMILES notation for 3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid?
The canonical SMILES for 3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid is CC(CC(=O)O)CC(=O)NC(=O)NN1CCOCC1.
What is the InChIKey of 3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid?
The InChIKey is PCNUMIHUFHNTAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O5/c1-8(7-10(16)17)6-9(15)12-11(18)13-14-2-4-19-5-3-14/h8H,2-7H2,1H3,(H,16,17)(H2,12,13,15,18).
What are the key properties of 3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid?
3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid has a molecular weight of 273.29 g/mol, XLogP of -0.44, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(morpholin-4-ylcarbamoylamino)-5-oxopentanoic acid is sourced from PubChem (CID 83026209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).