1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine

C13H15Cl2N3 — CID 117254735

IUPAC1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine
SMILESClc1cccn2c(CC3CCCCN3)nc(Cl)c12
InChIInChI=1S/C13H15Cl2N3/c14-10-5-3-7-18-11(17-13(15)12(10)18)8-9-4-1-2-6-16-9/h3,5,7,9,16H,1-2,4,6,8H2
InChIKeyDKAMCPXWGVMJBP-UHFFFAOYSA-N
MW284.19 g/mol
LogP3.33
Rot. Bonds2

About 1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine

1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine (PubChem CID 117254735) has the molecular formula C13H15Cl2N3 and a molecular weight of 284.19 g/mol. Its IUPAC name is 1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine
PubChem CID117254735
Molecular FormulaC13H15Cl2N3
Molecular Weight284.19 g/mol
Exact Mass283.06
IUPAC Name1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine
SMILESClc1cccn2c(CC3CCCCN3)nc(Cl)c12
InChIInChI=1S/C13H15Cl2N3/c14-10-5-3-7-18-11(17-13(15)12(10)18)8-9-4-1-2-6-16-9/h3,5,7,9,16H,1-2,4,6,8H2
InChIKeyDKAMCPXWGVMJBP-UHFFFAOYSA-N
XLogP3.33
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.19
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-bromo-8-chloro-3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridine
CID 117254720
1-bromo-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridin-8-ol
CID 117254727
8-methoxy-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117254731
methyl 8-methoxy-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylate
CID 117254732
8-bromo-3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carbonitrile
CID 84744210
4-chloro-1-methyl-2-(pyrrolidin-2-ylmethyl)benzimidazole
CID 84633647
methyl 8-amino-3-(pyrrolidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylate
CID 117254722
6-(piperidin-2-ylmethyl)imidazo[1,5-a]pyrimidine
CID 105470149
1-bromo-8-chloro-3-(pyrrolidin-3-ylmethyl)imidazo[1,5-a]pyridine
CID 117254778
6-chloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117253586
2-[(2-bromo-6-chlorophenyl)methyl]piperidine
CID 117466290
1-chloro-2-methyl-3-(piperidin-2-ylmethyl)indolizine
CID 116993733

Frequently Asked Questions

What is the IUPAC name of 1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine?
The IUPAC name of 1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine (CID 117254735) is 1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine?
The canonical SMILES for 1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine is Clc1cccn2c(CC3CCCCN3)nc(Cl)c12.
What is the InChIKey of 1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine?
The InChIKey is DKAMCPXWGVMJBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl2N3/c14-10-5-3-7-18-11(17-13(15)12(10)18)8-9-4-1-2-6-16-9/h3,5,7,9,16H,1-2,4,6,8H2.
What are the key properties of 1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine?
1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine has a molecular weight of 284.19 g/mol, XLogP of 3.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-dichloro-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 117254735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).