5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine

C14H11ClN2O — CID 117142201

IUPAC5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine
SMILESCOc1cccc(-c2ncc3cccc(Cl)n23)c1
InChIInChI=1S/C14H11ClN2O/c1-18-12-6-2-4-10(8-12)14-16-9-11-5-3-7-13(15)17(11)14/h2-9H,1H3
InChIKeyRSJLTODADDHWHR-UHFFFAOYSA-N
MW258.71 g/mol
LogP3.66
Rot. Bonds2

About 5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine

5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine (PubChem CID 117142201) has the molecular formula C14H11ClN2O and a molecular weight of 258.71 g/mol. Its IUPAC name is 5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine
PubChem CID117142201
Molecular FormulaC14H11ClN2O
Molecular Weight258.71 g/mol
Exact Mass258.06
IUPAC Name5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine
SMILESCOc1cccc(-c2ncc3cccc(Cl)n23)c1
InChIInChI=1S/C14H11ClN2O/c1-18-12-6-2-4-10(8-12)14-16-9-11-5-3-7-13(15)17(11)14/h2-9H,1H3
InChIKeyRSJLTODADDHWHR-UHFFFAOYSA-N
XLogP3.66
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.71
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

3-(5-chloroimidazo[1,5-a]pyridin-3-yl)phenol
CID 117142200
6-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine
CID 117139805
3-(4-methoxyphenyl)-5-methylimidazo[1,5-a]pyridine
CID 117142312
3-(4-methoxyphenyl)imidazo[1,5-a]pyridin-5-amine
CID 117142314
[3-(3-methoxyphenyl)imidazo[1,5-a]pyridin-6-yl]methanamine
CID 117138394
2-(3-methoxyphenyl)-5-methylpyrimidine
CID 121432653
5-chloro-3-naphthalen-2-yl-7-phenylimidazo[1,5-a]pyridine
CID 58880687
5-chloro-2-(3-methoxyphenyl)imidazo[1,2-a]pyridine-3-carbonitrile
CID 82342890
5-chloro-2-(3-methoxyphenyl)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 82342872
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
1-bromo-2-(3-methoxyphenyl)imidazole
CID 175313145

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine?
The IUPAC name of 5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine (CID 117142201) is 5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine?
The canonical SMILES for 5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine is COc1cccc(-c2ncc3cccc(Cl)n23)c1.
What is the InChIKey of 5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine?
The InChIKey is RSJLTODADDHWHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O/c1-18-12-6-2-4-10(8-12)14-16-9-11-5-3-7-13(15)17(11)14/h2-9H,1H3.
What are the key properties of 5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine?
5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine has a molecular weight of 258.71 g/mol, XLogP of 3.66, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 117142201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).