2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid

C15H28N2O4 — CID 102744971

IUPAC2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid
SMILESCC(C)CN(CC(=O)O)C(=O)N1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C15H28N2O4/c1-11(2)7-16(8-12(18)19)13(20)17-9-14(3,4)21-15(5,6)10-17/h11H,7-10H2,1-6H3,(H,18,19)
InChIKeyKYSXSIXDVCCMKO-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.04
Rot. Bonds4

About 2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid

2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid (PubChem CID 102744971) has the molecular formula C15H28N2O4 and a molecular weight of 300.40 g/mol. Its IUPAC name is 2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid
PubChem CID102744971
Molecular FormulaC15H28N2O4
Molecular Weight300.40 g/mol
Exact Mass300.20
IUPAC Name2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid
SMILESCC(C)CN(CC(=O)O)C(=O)N1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C15H28N2O4/c1-11(2)7-16(8-12(18)19)13(20)17-9-14(3,4)21-15(5,6)10-17/h11H,7-10H2,1-6H3,(H,18,19)
InChIKeyKYSXSIXDVCCMKO-UHFFFAOYSA-N
XLogP2.04
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2,2,2-Trifluoroethyl-(2,2,6-trimethylmorpholine-4-carbonyl)amino]acetic acid
CID 79264426
2-[(2,2-Dimethylmorpholine-4-carbonyl)-(2,2,2-trifluoroethyl)amino]acetic acid
CID 79266108
Tert-butyl(3-methyl-2-oxotetrahydropyrimidin-1(2H)-yl)acetate
CID 59011720
4-[2-[(2-Methylpropan-2-yl)oxy]-2-oxoethyl]piperazine-1-carboxylic acid
CID 71066000
2-[3,5-Bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]acetic acid
CID 145748996
2-[(2,6-Dimethylmorpholine-4-carbonyl)-methylamino]acetic acid
CID 43135704
2-[Methyl-(2-methylmorpholine-4-carbonyl)amino]acetic acid
CID 43135711
2-[(2,5-Dimethylmorpholine-4-carbonyl)-methylamino]acetic acid
CID 43544964
2-[(2-Ethylmorpholine-4-carbonyl)-methylamino]acetic acid
CID 43563042
2-[(2,2-Dimethylmorpholine-4-carbonyl)-methylamino]acetic acid
CID 43593154
Ethyl 2-[(2,2-dimethylmorpholine-4-carbonyl)amino]acetate
CID 43593180
2-[(2,2-Dimethylmorpholine-4-carbonyl)amino]acetic acid
CID 43593181

Frequently Asked Questions

What is the IUPAC name of 2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid?
The IUPAC name of 2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid (CID 102744971) is 2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid is CC(C)CN(CC(=O)O)C(=O)N1CC(C)(C)OC(C)(C)C1.
What is the InChIKey of 2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid?
The InChIKey is KYSXSIXDVCCMKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O4/c1-11(2)7-16(8-12(18)19)13(20)17-9-14(3,4)21-15(5,6)10-17/h11H,7-10H2,1-6H3,(H,18,19).
What are the key properties of 2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid?
2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid has a molecular weight of 300.40 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methylpropyl-(2,2,6,6-tetramethylmorpholine-4-carbonyl)amino]acetic acid is sourced from PubChem (CID 102744971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).