3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine

C12H11BrN4O — CID 158513969

IUPAC3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine
SMILESCOc1cn2c(Br)cnc2cc1-c1cnn(C)c1
InChIInChI=1S/C12H11BrN4O/c1-16-6-8(4-15-16)9-3-12-14-5-11(13)17(12)7-10(9)18-2/h3-7H,1-2H3
InChIKeyHLKCBCYVXBPOQU-UHFFFAOYSA-N
MW307.15 g/mol
LogP2.51
Rot. Bonds2

About 3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine

3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine (PubChem CID 158513969) has the molecular formula C12H11BrN4O and a molecular weight of 307.15 g/mol. Its IUPAC name is 3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine
PubChem CID158513969
Molecular FormulaC12H11BrN4O
Molecular Weight307.15 g/mol
Exact Mass306.01
IUPAC Name3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine
SMILESCOc1cn2c(Br)cnc2cc1-c1cnn(C)c1
InChIInChI=1S/C12H11BrN4O/c1-16-6-8(4-15-16)9-3-12-14-5-11(13)17(12)7-10(9)18-2/h3-7H,1-2H3
InChIKeyHLKCBCYVXBPOQU-UHFFFAOYSA-N
XLogP2.51
TPSA44.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.15
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-bromo-7-methoxy-6-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 172632182
3-bromo-7-methoxyimidazo[1,2-a]pyridine-6-carbonitrile
CID 130065101
7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
CID 121385724
4-methoxy-3-(1-methylpyrazol-4-yl)benzaldehyde
CID 82039718
3-bromo-7-(1-methylpyrazol-4-yl)-6-(oxolan-3-yloxy)imidazo[1,2-b]pyridazine
CID 166643766
[4,5-dimethoxy-2-(1-methylpyrazol-4-yl)phenyl]methanamine
CID 54980067
(3S)-3-[3-bromo-7-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazin-6-yl]oxypyrrolidin-2-one
CID 157157693
2-methoxy-4-methyl-5-(1-methylpyrazol-4-yl)benzoic acid
CID 146225350
4-(2-methoxyethoxy)-3-(1-methylpyrazol-4-yl)aniline
CID 165115982
4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridine
CID 146653020
2-methoxy-6-(1-methylpyrazol-4-yl)phenol
CID 83130518
3-bromo-4-fluoro-5-(1-methylpyrazol-4-yl)pyridin-2-amine
CID 118045204

Frequently Asked Questions

What is the IUPAC name of 3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine (CID 158513969) is 3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine is COc1cn2c(Br)cnc2cc1-c1cnn(C)c1.
What is the InChIKey of 3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine?
The InChIKey is HLKCBCYVXBPOQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN4O/c1-16-6-8(4-15-16)9-3-12-14-5-11(13)17(12)7-10(9)18-2/h3-7H,1-2H3.
What are the key properties of 3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine?
3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine has a molecular weight of 307.15 g/mol, XLogP of 2.51, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 158513969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).