2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine

C7H5ClN2O — CID 158628216

IUPAC2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine
SMILESCc1cc2oc(Cl)nc2cn1
InChIInChI=1S/C7H5ClN2O/c1-4-2-6-5(3-9-4)10-7(8)11-6/h2-3H,1H3
InChIKeyWATATGQMKBNLLY-UHFFFAOYSA-N
MW168.58 g/mol
LogP2.18
Rot. Bonds

About 2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine

2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine (PubChem CID 158628216) has the molecular formula C7H5ClN2O and a molecular weight of 168.58 g/mol. Its IUPAC name is 2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine.

Molecular Properties

Compound Name2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine
PubChem CID158628216
Molecular FormulaC7H5ClN2O
Molecular Weight168.58 g/mol
Exact Mass168.01
IUPAC Name2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine
SMILESCc1cc2oc(Cl)nc2cn1
InChIInChI=1S/C7H5ClN2O/c1-4-2-6-5(3-9-4)10-7(8)11-6/h2-3H,1H3
InChIKeyWATATGQMKBNLLY-UHFFFAOYSA-N
XLogP2.18
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.58
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine?
The IUPAC name of 2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine (CID 158628216) is 2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine.
What is the SMILES notation for 2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine?
The canonical SMILES for 2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine is Cc1cc2oc(Cl)nc2cn1.
What is the InChIKey of 2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine?
The InChIKey is WATATGQMKBNLLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClN2O/c1-4-2-6-5(3-9-4)10-7(8)11-6/h2-3H,1H3.
What are the key properties of 2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine?
2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine has a molecular weight of 168.58 g/mol, XLogP of 2.18, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-methyl-[1,3]oxazolo[4,5-c]pyridine is sourced from PubChem (CID 158628216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).