1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine

C13H16ClN3 — CID 84741989

IUPAC1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine
SMILESCc1ccn2c(C3CCNCC3)nc(Cl)c2c1
InChIInChI=1S/C13H16ClN3/c1-9-4-7-17-11(8-9)12(14)16-13(17)10-2-5-15-6-3-10/h4,7-8,10,15H,2-3,5-6H2,1H3
InChIKeyXESHZNMYUUCNHH-UHFFFAOYSA-N
MW249.74 g/mol
LogP2.76
Rot. Bonds1

About 1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine

1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine (PubChem CID 84741989) has the molecular formula C13H16ClN3 and a molecular weight of 249.74 g/mol. Its IUPAC name is 1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine
PubChem CID84741989
Molecular FormulaC13H16ClN3
Molecular Weight249.74 g/mol
Exact Mass249.10
IUPAC Name1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine
SMILESCc1ccn2c(C3CCNCC3)nc(Cl)c2c1
InChIInChI=1S/C13H16ClN3/c1-9-4-7-17-11(8-9)12(14)16-13(17)10-2-5-15-6-3-10/h4,7-8,10,15H,2-3,5-6H2,1H3
InChIKeyXESHZNMYUUCNHH-UHFFFAOYSA-N
XLogP2.76
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.74
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,7-dichloro-3-piperidin-4-ylimidazo[1,5-a]pyridine
CID 117254036
7-methyl-3-piperidin-4-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 75357455
1,7-dichloro-3-piperidin-3-ylimidazo[1,5-a]pyridine
CID 117254087
1-bromo-3-cyclobutyl-7-methylimidazo[1,5-a]pyridine
CID 83844519
3-(azetidin-3-yl)-1-chloro-7-methoxyimidazo[1,5-a]pyridine
CID 117254044
3-(azetidin-3-yl)-1-chloroimidazo[1,5-a]pyridin-7-ol
CID 117254042
1-chloro-3-piperidin-3-ylimidazo[1,5-a]pyridin-7-amine
CID 117254085
1-chloro-3-(thian-4-yl)imidazo[1,5-a]pyridin-7-amine
CID 117251665
1-chloro-3-(1-propan-2-ylpiperidin-4-yl)imidazo[1,5-a]pyridin-7-ol
CID 117251680
3-(azetidin-3-yl)-7-methylimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117254064
4-(4,5-dichloro-1-methylimidazol-2-yl)piperidine
CID 118294869
1-chloro-3-(4-chlorophenyl)-7-methylimidazo[1,5-a]pyridine
CID 117252034

Frequently Asked Questions

What is the IUPAC name of 1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine?
The IUPAC name of 1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine (CID 84741989) is 1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine.
What is the SMILES notation for 1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine?
The canonical SMILES for 1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine is Cc1ccn2c(C3CCNCC3)nc(Cl)c2c1.
What is the InChIKey of 1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine?
The InChIKey is XESHZNMYUUCNHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClN3/c1-9-4-7-17-11(8-9)12(14)16-13(17)10-2-5-15-6-3-10/h4,7-8,10,15H,2-3,5-6H2,1H3.
What are the key properties of 1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine?
1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine has a molecular weight of 249.74 g/mol, XLogP of 2.76, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-7-methyl-3-piperidin-4-ylimidazo[1,5-a]pyridine is sourced from PubChem (CID 84741989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).