2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one

C12H14N2O2 — CID 117133762

IUPAC2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one
SMILESO=c1ccn2cc(CC3CCOC3)[nH]c2c1
InChIInChI=1S/C12H14N2O2/c15-11-1-3-14-7-10(13-12(14)6-11)5-9-2-4-16-8-9/h1,3,6-7,9,13H,2,4-5,8H2
InChIKeyLBKDBENKVXCHFI-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.21
Rot. Bonds2

About 2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one

2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one (PubChem CID 117133762) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one.

Molecular Properties

Compound Name2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one
PubChem CID117133762
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one
SMILESO=c1ccn2cc(CC3CCOC3)[nH]c2c1
InChIInChI=1S/C12H14N2O2/c15-11-1-3-14-7-10(13-12(14)6-11)5-9-2-4-16-8-9/h1,3,6-7,9,13H,2,4-5,8H2
InChIKeyLBKDBENKVXCHFI-UHFFFAOYSA-N
XLogP1.21
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine-7-carbaldehyde
CID 117133746
2-(thian-2-yl)-1H-imidazo[1,2-a]pyridin-7-one
CID 117134296
4-(chloromethyl)-2-(oxolan-3-ylmethyl)-1H-pyrimidin-6-one
CID 136886289
7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117134668
3-(oxolan-3-ylmethyl)-7-piperazin-1-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 117236129
8-bromo-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117136060
4-(oxolan-3-ylmethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 66559053
8-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117136059
4-(oxolan-3-ylmethyl)benzaldehyde
CID 105444209
2-(oxolan-3-ylmethyl)-1,2-oxazol-3-one
CID 130614201
2-oxo-1-(oxolan-3-ylmethyl)pyridine-3-carbaldehyde
CID 121208404
4-(oxolan-3-ylmethoxy)-1H-pyridazin-6-one
CID 103241501

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one?
The IUPAC name of 2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one (CID 117133762) is 2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one.
What is the SMILES notation for 2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one?
The canonical SMILES for 2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one is O=c1ccn2cc(CC3CCOC3)[nH]c2c1.
What is the InChIKey of 2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one?
The InChIKey is LBKDBENKVXCHFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c15-11-1-3-14-7-10(13-12(14)6-11)5-9-2-4-16-8-9/h1,3,6-7,9,13H,2,4-5,8H2.
What are the key properties of 2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one?
2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one has a molecular weight of 218.26 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-3-ylmethyl)-1H-imidazo[1,2-a]pyridin-7-one is sourced from PubChem (CID 117133762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).