2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid

C14H16ClN3O2 — CID 61371922

IUPAC2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid
SMILESO=C(O)CC1CCCN1Cc1cn2cc(Cl)ccc2n1
InChIInChI=1S/C14H16ClN3O2/c15-10-3-4-13-16-11(9-18(13)7-10)8-17-5-1-2-12(17)6-14(19)20/h3-4,7,9,12H,1-2,5-6,8H2,(H,19,20)
InChIKeyUFQVUXTWXDTPQH-UHFFFAOYSA-N
MW293.75 g/mol
LogP2.43
Rot. Bonds4

About 2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid

2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid (PubChem CID 61371922) has the molecular formula C14H16ClN3O2 and a molecular weight of 293.75 g/mol. Its IUPAC name is 2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid
PubChem CID61371922
Molecular FormulaC14H16ClN3O2
Molecular Weight293.75 g/mol
Exact Mass293.09
IUPAC Name2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid
SMILESO=C(O)CC1CCCN1Cc1cn2cc(Cl)ccc2n1
InChIInChI=1S/C14H16ClN3O2/c15-10-3-4-13-16-11(9-18(13)7-10)8-17-5-1-2-12(17)6-14(19)20/h3-4,7,9,12H,1-2,5-6,8H2,(H,19,20)
InChIKeyUFQVUXTWXDTPQH-UHFFFAOYSA-N
XLogP2.43
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.75
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid?
The IUPAC name of 2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid (CID 61371922) is 2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid.
What is the SMILES notation for 2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid?
The canonical SMILES for 2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid is O=C(O)CC1CCCN1Cc1cn2cc(Cl)ccc2n1.
What is the InChIKey of 2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid?
The InChIKey is UFQVUXTWXDTPQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClN3O2/c15-10-3-4-13-16-11(9-18(13)7-10)8-17-5-1-2-12(17)6-14(19)20/h3-4,7,9,12H,1-2,5-6,8H2,(H,19,20).
What are the key properties of 2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid?
2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid has a molecular weight of 293.75 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]acetic acid is sourced from PubChem (CID 61371922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).