2-(morpholin-4-ylmethyl)pentanoic acid

C10H19NO3 — CID 23297629

IUPAC2-(morpholin-4-ylmethyl)pentanoic acid
SMILESCCCC(CN1CCOCC1)C(=O)O
InChIInChI=1S/C10H19NO3/c1-2-3-9(10(12)13)8-11-4-6-14-7-5-11/h9H,2-8H2,1H3,(H,12,13)
InChIKeyCUPBMOMCRLJDTM-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.82
Rot. Bonds5

About 2-(morpholin-4-ylmethyl)pentanoic acid

2-(morpholin-4-ylmethyl)pentanoic acid (PubChem CID 23297629) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-(morpholin-4-ylmethyl)pentanoic acid.

Molecular Properties

Compound Name2-(morpholin-4-ylmethyl)pentanoic acid
PubChem CID23297629
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name2-(morpholin-4-ylmethyl)pentanoic acid
SMILESCCCC(CN1CCOCC1)C(=O)O
InChIInChI=1S/C10H19NO3/c1-2-3-9(10(12)13)8-11-4-6-14-7-5-11/h9H,2-8H2,1H3,(H,12,13)
InChIKeyCUPBMOMCRLJDTM-UHFFFAOYSA-N
XLogP0.82
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(morpholin-4-ylmethyl)pentanoic acid?
The IUPAC name of 2-(morpholin-4-ylmethyl)pentanoic acid (CID 23297629) is 2-(morpholin-4-ylmethyl)pentanoic acid.
What is the SMILES notation for 2-(morpholin-4-ylmethyl)pentanoic acid?
The canonical SMILES for 2-(morpholin-4-ylmethyl)pentanoic acid is CCCC(CN1CCOCC1)C(=O)O.
What is the InChIKey of 2-(morpholin-4-ylmethyl)pentanoic acid?
The InChIKey is CUPBMOMCRLJDTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-2-3-9(10(12)13)8-11-4-6-14-7-5-11/h9H,2-8H2,1H3,(H,12,13).
What are the key properties of 2-(morpholin-4-ylmethyl)pentanoic acid?
2-(morpholin-4-ylmethyl)pentanoic acid has a molecular weight of 201.27 g/mol, XLogP of 0.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(morpholin-4-ylmethyl)pentanoic acid is sourced from PubChem (CID 23297629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).