2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid

C14H17N3O3 — CID 82028868

IUPAC2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid
SMILESO=C(O)Cc1nc2ccccn2c1CN1CCOCC1
InChIInChI=1S/C14H17N3O3/c18-14(19)9-11-12(10-16-5-7-20-8-6-16)17-4-2-1-3-13(17)15-11/h1-4H,5-10H2,(H,18,19)
InChIKeyDPIVGGNFSIONPA-UHFFFAOYSA-N
MW275.31 g/mol
LogP0.79
Rot. Bonds4

About 2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid

2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid (PubChem CID 82028868) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid
PubChem CID82028868
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid
SMILESO=C(O)Cc1nc2ccccn2c1CN1CCOCC1
InChIInChI=1S/C14H17N3O3/c18-14(19)9-11-12(10-16-5-7-20-8-6-16)17-4-2-1-3-13(17)15-11/h1-4H,5-10H2,(H,18,19)
InChIKeyDPIVGGNFSIONPA-UHFFFAOYSA-N
XLogP0.79
TPSA67.07 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid?
The IUPAC name of 2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid (CID 82028868) is 2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid.
What is the SMILES notation for 2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid?
The canonical SMILES for 2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid is O=C(O)Cc1nc2ccccn2c1CN1CCOCC1.
What is the InChIKey of 2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid?
The InChIKey is DPIVGGNFSIONPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c18-14(19)9-11-12(10-16-5-7-20-8-6-16)17-4-2-1-3-13(17)15-11/h1-4H,5-10H2,(H,18,19).
What are the key properties of 2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid?
2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid has a molecular weight of 275.31 g/mol, XLogP of 0.79, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid is sourced from PubChem (CID 82028868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).