1-imidazo[1,2-a]pyridin-7-ylbutan-1-one

C11H12N2O — CID 158316553

IUPAC1-imidazo[1,2-a]pyridin-7-ylbutan-1-one
SMILESCCCC(=O)c1ccn2ccnc2c1
InChIInChI=1S/C11H12N2O/c1-2-3-10(14)9-4-6-13-7-5-12-11(13)8-9/h4-8H,2-3H2,1H3
InChIKeyISNHFXYODNWOAW-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.32
Rot. Bonds3

About 1-imidazo[1,2-a]pyridin-7-ylbutan-1-one

1-imidazo[1,2-a]pyridin-7-ylbutan-1-one (PubChem CID 158316553) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 1-imidazo[1,2-a]pyridin-7-ylbutan-1-one.

Molecular Properties

Compound Name1-imidazo[1,2-a]pyridin-7-ylbutan-1-one
PubChem CID158316553
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name1-imidazo[1,2-a]pyridin-7-ylbutan-1-one
SMILESCCCC(=O)c1ccn2ccnc2c1
InChIInChI=1S/C11H12N2O/c1-2-3-10(14)9-4-6-13-7-5-12-11(13)8-9/h4-8H,2-3H2,1H3
InChIKeyISNHFXYODNWOAW-UHFFFAOYSA-N
XLogP2.32
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;1-imidazo[1,2-a]pyridin-7-ylpropan-1-one
CID 143707099
imidazo[1,2-a]pyridine-7-carboxylic acid;1-imidazo[1,2-a]pyridin-7-ylbutan-1-one;1-(3-iodoimidazo[1,2-a]pyridin-7-yl)butan-1-one;methane;hydrochloride
CID 161410263
N-(2-imidazo[1,2-a]pyridin-7-yl-2-oxoethyl)acetamide
CID 59320836
(Z)-4-hydroxy-4-imidazo[1,2-a]pyridin-7-yl-3-methylbut-3-en-2-one
CID 59320858
1-(3-iodoimidazo[1,2-a]pyridin-7-yl)butan-1-one
CID 158316554
N-(2-aminoethyl)imidazo[1,2-a]pyridine-7-carboxamide
CID 172844439
7-ethylimidazo[1,2-a]pyridine
CID 18184463
methyl 4-[(imidazo[1,2-a]pyridine-7-carbonylamino)methyl]benzoate
CID 175026463
1-(6-butanoylnaphthalen-2-yl)butan-1-one
CID 170450514
(E)-3-[4-[(E)-1-imidazo[1,2-a]pyridin-7-yl-2-phenylbut-1-enyl]phenyl]prop-2-enoic acid
CID 155561414
3-amino-N-(imidazo[1,2-a]pyridin-7-ylmethyl)propanamide
CID 119889538
1-(3-bromophenyl)butan-1-one
CID 18417701

Frequently Asked Questions

What is the IUPAC name of 1-imidazo[1,2-a]pyridin-7-ylbutan-1-one?
The IUPAC name of 1-imidazo[1,2-a]pyridin-7-ylbutan-1-one (CID 158316553) is 1-imidazo[1,2-a]pyridin-7-ylbutan-1-one.
What is the SMILES notation for 1-imidazo[1,2-a]pyridin-7-ylbutan-1-one?
The canonical SMILES for 1-imidazo[1,2-a]pyridin-7-ylbutan-1-one is CCCC(=O)c1ccn2ccnc2c1.
What is the InChIKey of 1-imidazo[1,2-a]pyridin-7-ylbutan-1-one?
The InChIKey is ISNHFXYODNWOAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-2-3-10(14)9-4-6-13-7-5-12-11(13)8-9/h4-8H,2-3H2,1H3.
What are the key properties of 1-imidazo[1,2-a]pyridin-7-ylbutan-1-one?
1-imidazo[1,2-a]pyridin-7-ylbutan-1-one has a molecular weight of 188.23 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-imidazo[1,2-a]pyridin-7-ylbutan-1-one is sourced from PubChem (CID 158316553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).