2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid

C15H19NO3 — CID 64528521

IUPAC2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid
SMILESO=C(O)CC1(N2CCOCC2)CCc2ccccc21
InChIInChI=1S/C15H19NO3/c17-14(18)11-15(16-7-9-19-10-8-16)6-5-12-3-1-2-4-13(12)15/h1-4H,5-11H2,(H,17,18)
InChIKeySEJKBIFKPWRSDY-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.63
Rot. Bonds3

About 2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid

2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid (PubChem CID 64528521) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid.

Molecular Properties

Compound Name2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid
PubChem CID64528521
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC Name2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid
SMILESO=C(O)CC1(N2CCOCC2)CCc2ccccc21
InChIInChI=1S/C15H19NO3/c17-14(18)11-15(16-7-9-19-10-8-16)6-5-12-3-1-2-4-13(12)15/h1-4H,5-11H2,(H,17,18)
InChIKeySEJKBIFKPWRSDY-UHFFFAOYSA-N
XLogP1.63
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid?
The IUPAC name of 2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid (CID 64528521) is 2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid.
What is the SMILES notation for 2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid?
The canonical SMILES for 2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid is O=C(O)CC1(N2CCOCC2)CCc2ccccc21.
What is the InChIKey of 2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid?
The InChIKey is SEJKBIFKPWRSDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c17-14(18)11-15(16-7-9-19-10-8-16)6-5-12-3-1-2-4-13(12)15/h1-4H,5-11H2,(H,17,18).
What are the key properties of 2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid?
2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid has a molecular weight of 261.32 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-morpholin-4-yl-2,3-dihydroinden-1-yl)acetic acid is sourced from PubChem (CID 64528521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).