2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid

C14H26N2O4 — CID 61424809

IUPAC2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid
SMILESCCCC(C)(NC(=O)N1CC(C)OCC1CC)C(=O)O
InChIInChI=1S/C14H26N2O4/c1-5-7-14(4,12(17)18)15-13(19)16-8-10(3)20-9-11(16)6-2/h10-11H,5-9H2,1-4H3,(H,15,19)(H,17,18)
InChIKeyNDERHRHZJLLVCQ-UHFFFAOYSA-N
MW286.37 g/mol
LogP1.84
Rot. Bonds5

About 2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid

2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid (PubChem CID 61424809) has the molecular formula C14H26N2O4 and a molecular weight of 286.37 g/mol. Its IUPAC name is 2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid.

Molecular Properties

Compound Name2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid
PubChem CID61424809
Molecular FormulaC14H26N2O4
Molecular Weight286.37 g/mol
Exact Mass286.19
IUPAC Name2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid
SMILESCCCC(C)(NC(=O)N1CC(C)OCC1CC)C(=O)O
InChIInChI=1S/C14H26N2O4/c1-5-7-14(4,12(17)18)15-13(19)16-8-10(3)20-9-11(16)6-2/h10-11H,5-9H2,1-4H3,(H,15,19)(H,17,18)
InChIKeyNDERHRHZJLLVCQ-UHFFFAOYSA-N
XLogP1.84
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-2-[(2-methyl-1,4-oxazepane-4-carbonyl)amino]pentanoic acid
CID 55139798
3-(5-ethyl-2-methylmorpholin-4-yl)-2,2-dimethyl-3-oxopropanoic acid
CID 82821469
(2R)-2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]pentanoic acid
CID 107566402
1-(5-ethyl-2-methylmorpholin-4-yl)-2-methoxy-2-methylpropan-1-one
CID 103029074
3-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]butanoic acid
CID 61424705
N-cyclopentyl-5-ethyl-2-methylmorpholine-4-carboxamide
CID 113222805
3-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpropanoic acid
CID 62669577
4-amino-2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-4-oxobutanoic acid
CID 61425360
2-[2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-oxoethoxy]acetic acid
CID 61424649
4-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylbutanoic acid
CID 80540606
cyclopropyl-(5-ethyl-2-methylmorpholin-4-yl)methanone
CID 60645279
2-[[2-(hydroxymethyl)pyrrolidine-1-carbonyl]amino]-2-methylpentanoic acid
CID 61409614

Frequently Asked Questions

What is the IUPAC name of 2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid?
The IUPAC name of 2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid (CID 61424809) is 2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid.
What is the SMILES notation for 2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid?
The canonical SMILES for 2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid is CCCC(C)(NC(=O)N1CC(C)OCC1CC)C(=O)O.
What is the InChIKey of 2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid?
The InChIKey is NDERHRHZJLLVCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O4/c1-5-7-14(4,12(17)18)15-13(19)16-8-10(3)20-9-11(16)6-2/h10-11H,5-9H2,1-4H3,(H,15,19)(H,17,18).
What are the key properties of 2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid?
2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid has a molecular weight of 286.37 g/mol, XLogP of 1.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-ethyl-2-methylmorpholine-4-carbonyl)amino]-2-methylpentanoic acid is sourced from PubChem (CID 61424809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).