1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one

C12H14N2O — CID 84670710

IUPAC1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one
SMILESCC(=O)Cc1nc2cc(C)ccn2c1C
InChIInChI=1S/C12H14N2O/c1-8-4-5-14-10(3)11(7-9(2)15)13-12(14)6-8/h4-6H,7H2,1-3H3
InChIKeyPYGSNSCEGPLMGT-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.08
Rot. Bonds2

About 1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one

1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one (PubChem CID 84670710) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one.

Molecular Properties

Compound Name1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one
PubChem CID84670710
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one
SMILESCC(=O)Cc1nc2cc(C)ccn2c1C
InChIInChI=1S/C12H14N2O/c1-8-4-5-14-10(3)11(7-9(2)15)13-12(14)6-8/h4-6H,7H2,1-3H3
InChIKeyPYGSNSCEGPLMGT-UHFFFAOYSA-N
XLogP2.08
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methylimidazo[1,2-c]pyrimidin-2-yl)propan-2-one
CID 84661955
2-(7-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)acetic acid
CID 82356407
2-[7-methyl-3-[[methyl(2-pyridin-4-ylethyl)amino]methyl]imidazo[1,2-a]pyridin-2-yl]acetic acid
CID 82028895
3-bromo-7-methyl-2-(2-methylpropyl)imidazo[1,2-a]pyridine
CID 165493110
2-[(4-chlorophenyl)methyl]-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 82225523
(7-bromo-3-methylimidazo[1,2-a]pyridin-2-yl)methanol
CID 115044017
2-[7-methyl-3-[(4-methylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]acetic acid
CID 82028883
1-[4-[2-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)ethyl]-2-hydroxyphenyl]-3-propan-2-ylurea
CID 15684661
1-(7-iodo-3-methylimidazo[1,2-a]pyridin-2-yl)ethanone
CID 165042597
[2-[(4-chlorophenyl)methyl]-7-methylimidazo[1,2-a]pyridin-3-yl]methanol
CID 82223695
N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide
CID 2814534
(E)-3-[7-methyl-2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridin-3-yl]prop-2-enoic acid
CID 94964072

Frequently Asked Questions

What is the IUPAC name of 1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one?
The IUPAC name of 1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one (CID 84670710) is 1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one.
What is the SMILES notation for 1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one?
The canonical SMILES for 1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one is CC(=O)Cc1nc2cc(C)ccn2c1C.
What is the InChIKey of 1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one?
The InChIKey is PYGSNSCEGPLMGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-8-4-5-14-10(3)11(7-9(2)15)13-12(14)6-8/h4-6H,7H2,1-3H3.
What are the key properties of 1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one?
1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one has a molecular weight of 202.26 g/mol, XLogP of 2.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)propan-2-one is sourced from PubChem (CID 84670710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).