1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine

C12H14ClN3 — CID 83842069

IUPAC1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine
SMILESCc1nc(Cl)c2cccc(C3CCNC3)n12
InChIInChI=1S/C12H14ClN3/c1-8-15-12(13)11-4-2-3-10(16(8)11)9-5-6-14-7-9/h2-4,9,14H,5-7H2,1H3
InChIKeyCNEBQCNGIHHRBL-UHFFFAOYSA-N
MW235.72 g/mol
LogP2.37
Rot. Bonds1

About 1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine

1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine (PubChem CID 83842069) has the molecular formula C12H14ClN3 and a molecular weight of 235.72 g/mol. Its IUPAC name is 1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine
PubChem CID83842069
Molecular FormulaC12H14ClN3
Molecular Weight235.72 g/mol
Exact Mass235.09
IUPAC Name1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine
SMILESCc1nc(Cl)c2cccc(C3CCNC3)n12
InChIInChI=1S/C12H14ClN3/c1-8-15-12(13)11-4-2-3-10(16(8)11)9-5-6-14-7-9/h2-4,9,14H,5-7H2,1H3
InChIKeyCNEBQCNGIHHRBL-UHFFFAOYSA-N
XLogP2.37
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.72
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine
CID 83838573
3-methyl-5-piperidin-4-ylimidazo[1,5-a]pyridine
CID 83835722
7-chloro-1-methyl-2-pyrrolidin-3-ylindole
CID 84627998
3-chloro-5-piperidin-4-ylimidazo[1,2-a]pyridine
CID 83842070
3-(2-chloro-6-methylphenyl)pyrrolidine
CID 117103928
(3S)-3-(2,6-dimethylphenyl)pyrrolidine
CID 93478436
6-chloro-1,7-dimethyl-2-pyrrolidin-3-ylindole
CID 84633378
5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 82404941
2-chloro-3-methyl-5-pyrrolidin-3-ylpyrazine
CID 83831453
1-tert-butyl-2-pyrrolidin-3-ylbenzimidazole
CID 63030439
3,6-dimethyl-1-pyrrolidin-3-ylimidazo[1,5-a]pyridine
CID 83835706
5,7-dimethyl-3-pyrrolidin-3-yl-[1,2,4]triazolo[4,3-c]pyrimidine
CID 79817922

Frequently Asked Questions

What is the IUPAC name of 1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine?
The IUPAC name of 1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine (CID 83842069) is 1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine.
What is the SMILES notation for 1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine?
The canonical SMILES for 1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine is Cc1nc(Cl)c2cccc(C3CCNC3)n12.
What is the InChIKey of 1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine?
The InChIKey is CNEBQCNGIHHRBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClN3/c1-8-15-12(13)11-4-2-3-10(16(8)11)9-5-6-14-7-9/h2-4,9,14H,5-7H2,1H3.
What are the key properties of 1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine?
1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine has a molecular weight of 235.72 g/mol, XLogP of 2.37, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-3-methyl-5-pyrrolidin-3-ylimidazo[1,5-a]pyridine is sourced from PubChem (CID 83842069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).