[3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone

C18H19N3OS — CID 132764006

IUPAC[3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone
SMILESCc1cn2c(C3CCCN(C(=O)c4cccs4)C3)cccc2n1
InChIInChI=1S/C18H19N3OS/c1-13-11-21-15(6-2-8-17(21)19-13)14-5-3-9-20(12-14)18(22)16-7-4-10-23-16/h2,4,6-8,10-11,14H,3,5,9,12H2,1H3
InChIKeyVJUMXQLTAOKDDA-UHFFFAOYSA-N
MW325.44 g/mol
LogP3.72
Rot. Bonds2

About [3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone

[3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone (PubChem CID 132764006) has the molecular formula C18H19N3OS and a molecular weight of 325.44 g/mol. Its IUPAC name is [3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone.

Molecular Properties

Compound Name[3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone
PubChem CID132764006
Molecular FormulaC18H19N3OS
Molecular Weight325.44 g/mol
Exact Mass325.12
IUPAC Name[3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone
SMILESCc1cn2c(C3CCCN(C(=O)c4cccs4)C3)cccc2n1
InChIInChI=1S/C18H19N3OS/c1-13-11-21-15(6-2-8-17(21)19-13)14-5-3-9-20(12-14)18(22)16-7-4-10-23-16/h2,4,6-8,10-11,14H,3,5,9,12H2,1H3
InChIKeyVJUMXQLTAOKDDA-UHFFFAOYSA-N
XLogP3.72
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.44
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[(3S)-3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-pyrimidin-5-ylmethanone
CID 124943019
[(3R)-3-phenylpiperidin-1-yl]-thiophen-2-ylmethanone
CID 740549
N'-(4,6-dimethylpyrimidin-2-yl)-1-(thiophene-2-carbonyl)piperidine-3-carbohydrazide
CID 46557972
[3-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-thiophen-2-ylmethanone
CID 3226119
[(3S)-3-(methylamino)piperidin-1-yl]-thiophen-2-ylmethanone
CID 94475795
(3-imidazo[1,2-a]pyrimidin-5-ylpyrrolidin-1-yl)-thiophen-2-ylmethanone
CID 110110280
thiophen-2-yl-[3-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidin-1-yl]methanone
CID 110214031
(3R)-1-(thiophene-2-carbonyl)piperidine-3-carboxylic acid
CID 858666
[(3S)-3-(4-methylsulfonyl-1H-pyrazol-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone
CID 124945178
[3-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-thiophen-2-ylmethanone
CID 70316849
[(3S)-3-[2-methyl-6-(1-methylimidazol-2-yl)pyrimidin-4-yl]piperidin-1-yl]-thiophen-2-ylmethanone
CID 124964692
[3-(cyclopentylamino)piperidin-1-yl]-thiophen-2-ylmethanone
CID 83999954

Frequently Asked Questions

What is the IUPAC name of [3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone?
The IUPAC name of [3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone (CID 132764006) is [3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone.
What is the SMILES notation for [3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone?
The canonical SMILES for [3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone is Cc1cn2c(C3CCCN(C(=O)c4cccs4)C3)cccc2n1.
What is the InChIKey of [3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone?
The InChIKey is VJUMXQLTAOKDDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3OS/c1-13-11-21-15(6-2-8-17(21)19-13)14-5-3-9-20(12-14)18(22)16-7-4-10-23-16/h2,4,6-8,10-11,14H,3,5,9,12H2,1H3.
What are the key properties of [3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone?
[3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone has a molecular weight of 325.44 g/mol, XLogP of 3.72, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methylimidazo[1,2-a]pyridin-5-yl)piperidin-1-yl]-thiophen-2-ylmethanone is sourced from PubChem (CID 132764006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).