(2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid

C14H24N2O5 — CID 119363098

IUPAC(2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid
SMILESCC(C)C[C@@H](NC(=O)CCC(=O)N1CCOCC1)C(=O)O
InChIInChI=1S/C14H24N2O5/c1-10(2)9-11(14(19)20)15-12(17)3-4-13(18)16-5-7-21-8-6-16/h10-11H,3-9H2,1-2H3,(H,15,17)(H,19,20)/t11-/m1/s1
InChIKeyOXDXOKSQTVRJCQ-LLVKDONJSA-N
MW300.36 g/mol
LogP0.24
Rot. Bonds7

About (2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid

(2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid (PubChem CID 119363098) has the molecular formula C14H24N2O5 and a molecular weight of 300.36 g/mol. Its IUPAC name is (2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid.

Molecular Properties

Compound Name(2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid
PubChem CID119363098
Molecular FormulaC14H24N2O5
Molecular Weight300.36 g/mol
Exact Mass300.17
IUPAC Name(2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid
SMILESCC(C)C[C@@H](NC(=O)CCC(=O)N1CCOCC1)C(=O)O
InChIInChI=1S/C14H24N2O5/c1-10(2)9-11(14(19)20)15-12(17)3-4-13(18)16-5-7-21-8-6-16/h10-11H,3-9H2,1-2H3,(H,15,17)(H,19,20)/t11-/m1/s1
InChIKeyOXDXOKSQTVRJCQ-LLVKDONJSA-N
XLogP0.24
TPSA95.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid with MolForge

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Related Compounds

4-methyl-2-(1,4-oxazepane-4-carbonylamino)pentanoic acid
CID 62969212
(2S)-4-methyl-2-[(2-morpholin-4-ylacetyl)amino]pentanoic acid
CID 90040549
[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]carbamic acid
CID 175945134
4-morpholin-4-yl-4-oxo-N-[(1S)-1-phenylethyl]butanamide
CID 40719548
2-[3-(azepan-1-yl)propanoylamino]-4-methylpentanoic acid
CID 52983772
N-[1-(3,5-dimethylphenyl)propan-2-yl]-4-morpholin-4-yl-4-oxobutanamide
CID 122142633
(2R)-4-methyl-2-(2-morpholin-4-yl-2-oxoethyl)pentanoic acid
CID 54200282
4-(4-chlorophenyl)-N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]-4-oxobutanamide
CID 110305687
4-(4-fluorophenyl)-N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]-4-oxobutanamide
CID 110305686
(2R)-4-methyl-2-(2-morpholin-4-ylethylcarbamoylamino)pentanoic acid
CID 78976341
4-methyl-2-(3-methylsulfanylpropanoylamino)pentanoic acid
CID 43183366
methyl 4-methyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]pentanoate
CID 54940231

Frequently Asked Questions

What is the IUPAC name of (2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid?
The IUPAC name of (2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid (CID 119363098) is (2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid.
What is the SMILES notation for (2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid?
The canonical SMILES for (2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid is CC(C)C[C@@H](NC(=O)CCC(=O)N1CCOCC1)C(=O)O.
What is the InChIKey of (2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid?
The InChIKey is OXDXOKSQTVRJCQ-LLVKDONJSA-N. The full InChI is InChI=1S/C14H24N2O5/c1-10(2)9-11(14(19)20)15-12(17)3-4-13(18)16-5-7-21-8-6-16/h10-11H,3-9H2,1-2H3,(H,15,17)(H,19,20)/t11-/m1/s1.
What are the key properties of (2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid?
(2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid has a molecular weight of 300.36 g/mol, XLogP of 0.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-methyl-2-[(4-morpholin-4-yl-4-oxobutanoyl)amino]pentanoic acid is sourced from PubChem (CID 119363098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).