3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid

C11H22N2O3 — CID 82328722

IUPAC3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid
SMILESCN(CCCN1CCOCC1)CCC(=O)O
InChIInChI=1S/C11H22N2O3/c1-12(6-3-11(14)15)4-2-5-13-7-9-16-10-8-13/h2-10H2,1H3,(H,14,15)
InChIKeyCXIMWYDMHCEFNG-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.12
Rot. Bonds7

About 3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid

3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid (PubChem CID 82328722) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid.

Molecular Properties

Compound Name3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid
PubChem CID82328722
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid
SMILESCN(CCCN1CCOCC1)CCC(=O)O
InChIInChI=1S/C11H22N2O3/c1-12(6-3-11(14)15)4-2-5-13-7-9-16-10-8-13/h2-10H2,1H3,(H,14,15)
InChIKeyCXIMWYDMHCEFNG-UHFFFAOYSA-N
XLogP0.12
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[methyl(2-morpholin-4-ylethyl)amino]propanoic acid
CID 60987134
3-[3-morpholin-4-ylpropyl(propan-2-yl)amino]propanoic acid
CID 82328609
N-methyl-3-morpholin-4-yl-N-propylpropan-1-amine
CID 146735339
3-[(2-amino-2-oxoethyl)-(3-morpholin-4-ylpropyl)amino]propanoic acid
CID 82326743
2-methyl-1-[methyl(3-morpholin-4-ylpropyl)amino]propan-2-ol
CID 111488087
3-(2-morpholin-4-ylethylamino)propanoic acid
CID 28830354
5-morpholin-4-ylpentanehydrazide
CID 63570305
5-(2-morpholin-4-ylethylamino)pentanoic acid
CID 103235757
N-methyl-N-(3-morpholin-4-ylpropyl)benzamide
CID 67379055
6-(3-morpholin-4-ylpropylcarbamoylamino)hexanoic acid
CID 61194288
N-methyl-N-[(3-methylcyclopropen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine
CID 171540310
N-methyl-7-morpholin-4-ylheptanamide
CID 176680363

Frequently Asked Questions

What is the IUPAC name of 3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid?
The IUPAC name of 3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid (CID 82328722) is 3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid.
What is the SMILES notation for 3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid?
The canonical SMILES for 3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid is CN(CCCN1CCOCC1)CCC(=O)O.
What is the InChIKey of 3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid?
The InChIKey is CXIMWYDMHCEFNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-12(6-3-11(14)15)4-2-5-13-7-9-16-10-8-13/h2-10H2,1H3,(H,14,15).
What are the key properties of 3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid?
3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid has a molecular weight of 230.31 g/mol, XLogP of 0.12, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl(3-morpholin-4-ylpropyl)amino]propanoic acid is sourced from PubChem (CID 82328722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).