7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine

C12H15ClN4 — CID 82343226

IUPAC7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
SMILESClc1ccn2c(CN3CCNCC3)cnc2c1
InChIInChI=1S/C12H15ClN4/c13-10-1-4-17-11(8-15-12(17)7-10)9-16-5-2-14-3-6-16/h1,4,7-8,14H,2-3,5-6,9H2
InChIKeyVGPSIVDEJFOQSQ-UHFFFAOYSA-N
MW250.73 g/mol
LogP1.39
Rot. Bonds2

About 7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine

7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine (PubChem CID 82343226) has the molecular formula C12H15ClN4 and a molecular weight of 250.73 g/mol. Its IUPAC name is 7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
PubChem CID82343226
Molecular FormulaC12H15ClN4
Molecular Weight250.73 g/mol
Exact Mass250.10
IUPAC Name7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
SMILESClc1ccn2c(CN3CCNCC3)cnc2c1
InChIInChI=1S/C12H15ClN4/c13-10-1-4-17-11(8-15-12(17)7-10)9-16-5-2-14-3-6-16/h1,4,7-8,14H,2-3,5-6,9H2
InChIKeyVGPSIVDEJFOQSQ-UHFFFAOYSA-N
XLogP1.39
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.73
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-chloro-3-(pyrrolidin-1-ylmethyl)imidazo[1,2-a]pyridine
CID 117256482
7-chloro-3-(1,4-diazepan-1-ylmethyl)-2-methylimidazo[1,2-a]pyridine
CID 82343266
7-chloro-3-[(4-chlorophenoxy)methyl]imidazo[1,2-a]pyridine
CID 117256539
7-chloro-3-[(4-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine
CID 117256543
3-(2,7-diazaspiro[4.4]nonan-2-ylmethyl)-7-methylimidazo[1,2-a]pyridine
CID 120908377
7-chloroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 55265824
3-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 11278841
1,7-bis[(6-chloro-3-pyridinyl)methyl]-1,4,7,10-tetrazacyclododecane
CID 102314847
7-(piperazin-1-ylmethyl)imidazo[1,2-b][1,2,4]triazine
CID 83888234
1-[(5-bromo-4-methyl-2-pyridinyl)methyl]piperazine
CID 83903383
6-chloro-1-methyl-3-(piperazin-1-ylmethyl)indole
CID 82278751
1-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]piperazine
CID 167531096

Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine (CID 82343226) is 7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine is Clc1ccn2c(CN3CCNCC3)cnc2c1.
What is the InChIKey of 7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine?
The InChIKey is VGPSIVDEJFOQSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN4/c13-10-1-4-17-11(8-15-12(17)7-10)9-16-5-2-14-3-6-16/h1,4,7-8,14H,2-3,5-6,9H2.
What are the key properties of 7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine?
7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine has a molecular weight of 250.73 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 82343226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).