7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine

C13H15ClN2O — CID 117134668

IUPAC7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine
SMILESClc1ccn2cc(CC3CCCOC3)nc2c1
InChIInChI=1S/C13H15ClN2O/c14-11-3-4-16-8-12(15-13(16)7-11)6-10-2-1-5-17-9-10/h3-4,7-8,10H,1-2,5-6,9H2
InChIKeyODNGRUTXCZGIAS-UHFFFAOYSA-N
MW250.73 g/mol
LogP2.96
Rot. Bonds2

About 7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine

7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine (PubChem CID 117134668) has the molecular formula C13H15ClN2O and a molecular weight of 250.73 g/mol. Its IUPAC name is 7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine
PubChem CID117134668
Molecular FormulaC13H15ClN2O
Molecular Weight250.73 g/mol
Exact Mass250.09
IUPAC Name7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine
SMILESClc1ccn2cc(CC3CCCOC3)nc2c1
InChIInChI=1S/C13H15ClN2O/c14-11-3-4-16-8-12(15-13(16)7-11)6-10-2-1-5-17-9-10/h3-4,7-8,10H,1-2,5-6,9H2
InChIKeyODNGRUTXCZGIAS-UHFFFAOYSA-N
XLogP2.96
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.73
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine-7-carbaldehyde
CID 117133746
7-chloro-2-[(1-ethylpiperidin-4-yl)methyl]imidazo[1,2-a]pyridine
CID 117133939
6-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117129074
7-methyl-2-(oxan-4-ylmethyl)imidazo[1,2-a]pyridine
CID 117133889
7-chloro-2-[[(2S,6S)-2,6-dimethylpiperidin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 25333696
8-chloro-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117136059
7-chloro-2-(ethoxymethyl)imidazo[1,2-a]pyridine
CID 123431873
8-bromo-2-(oxolan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117136060
2-[[(3R)-oxolan-3-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 163213817
2-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-7-carboxylic acid
CID 117134469
2-(7-chloroimidazo[1,2-a]pyridin-2-yl)ethanethioamide
CID 82343240
[2-(pyrrolidin-3-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 117133738

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine (CID 117134668) is 7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine is Clc1ccn2cc(CC3CCCOC3)nc2c1.
What is the InChIKey of 7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine?
The InChIKey is ODNGRUTXCZGIAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2O/c14-11-3-4-16-8-12(15-13(16)7-11)6-10-2-1-5-17-9-10/h3-4,7-8,10H,1-2,5-6,9H2.
What are the key properties of 7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine?
7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine has a molecular weight of 250.73 g/mol, XLogP of 2.96, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-(oxan-3-ylmethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 117134668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).