6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine

C10H7ClN2 — CID 130603895

IUPAC6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine
SMILESC#Cc1cnc2c(C)cc(Cl)cn12
InChIInChI=1S/C10H7ClN2/c1-3-9-5-12-10-7(2)4-8(11)6-13(9)10/h1,4-6H,2H3
InChIKeyZUHRYBYKVBYNIT-UHFFFAOYSA-N
MW190.63 g/mol
LogP2.28
Rot. Bonds

About 6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine

6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine (PubChem CID 130603895) has the molecular formula C10H7ClN2 and a molecular weight of 190.63 g/mol. Its IUPAC name is 6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine
PubChem CID130603895
Molecular FormulaC10H7ClN2
Molecular Weight190.63 g/mol
Exact Mass190.03
IUPAC Name6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine
SMILESC#Cc1cnc2c(C)cc(Cl)cn12
InChIInChI=1S/C10H7ClN2/c1-3-9-5-12-10-7(2)4-8(11)6-13(9)10/h1,4-6H,2H3
InChIKeyZUHRYBYKVBYNIT-UHFFFAOYSA-N
XLogP2.28
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.63
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

6-chloro-8-methyl-3-propan-2-ylimidazo[1,2-a]pyridine
CID 130603885
1-(6-chloro-8-methylimidazo[1,2-a]pyridin-3-yl)propan-1-ol
CID 82531093
(E)-3-(6-chloro-8-methylimidazo[1,2-a]pyridin-3-yl)prop-2-enoic acid
CID 82531076
6-chloro-8-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 66636284
5-chloro-2-ethynyl-4-methylpyridine
CID 74888663
6-chloro-3-ethyl-2,8-dimethylimidazo[1,2-a]pyridine
CID 126985620
(6-chloro-2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methanol
CID 82531125
4-chloro-1-ethynyl-2-methylbenzene
CID 53426515
(6,8-dichloroimidazo[1,2-a]pyridin-3-yl)methanol
CID 82069651
(6,8-dichloroimidazo[1,2-a]pyridin-3-yl)methanamine
CID 82069649
6-chloro-8-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 82531054
2-(6-chloro-8-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile
CID 82531060

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine?
The IUPAC name of 6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine (CID 130603895) is 6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine.
What is the SMILES notation for 6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine?
The canonical SMILES for 6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine is C#Cc1cnc2c(C)cc(Cl)cn12.
What is the InChIKey of 6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine?
The InChIKey is ZUHRYBYKVBYNIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClN2/c1-3-9-5-12-10-7(2)4-8(11)6-13(9)10/h1,4-6H,2H3.
What are the key properties of 6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine?
6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine has a molecular weight of 190.63 g/mol, XLogP of 2.28, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-ethynyl-8-methylimidazo[1,2-a]pyridine is sourced from PubChem (CID 130603895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).