8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine

C17H20BrN5 — CID 166276525

IUPAC8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine
SMILESCn1ccnc1C1CCN(Cc2cn3cccc(Br)c3n2)CC1
InChIInChI=1S/C17H20BrN5/c1-21-10-6-19-16(21)13-4-8-22(9-5-13)11-14-12-23-7-2-3-15(18)17(23)20-14/h2-3,6-7,10,12-13H,4-5,8-9,11H2,1H3
InChIKeyUWGSAWSCAIWCNX-UHFFFAOYSA-N
MW374.29 g/mol
LogP3.21
Rot. Bonds3

About 8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine

8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine (PubChem CID 166276525) has the molecular formula C17H20BrN5 and a molecular weight of 374.29 g/mol. Its IUPAC name is 8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine
PubChem CID166276525
Molecular FormulaC17H20BrN5
Molecular Weight374.29 g/mol
Exact Mass373.09
IUPAC Name8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine
SMILESCn1ccnc1C1CCN(Cc2cn3cccc(Br)c3n2)CC1
InChIInChI=1S/C17H20BrN5/c1-21-10-6-19-16(21)13-4-8-22(9-5-13)11-14-12-23-7-2-3-15(18)17(23)20-14/h2-3,6-7,10,12-13H,4-5,8-9,11H2,1H3
InChIKeyUWGSAWSCAIWCNX-UHFFFAOYSA-N
XLogP3.21
TPSA38.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.29
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine with MolForge

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Related Compounds

8-bromo-2-cyclopropylimidazo[1,2-a]pyridine
CID 79016015
8-bromo-2-(1-ethylpiperidin-3-yl)imidazo[1,2-a]pyridine
CID 117136361
8-methyl-2-(pyrrolidin-1-ylmethyl)imidazo[1,2-a]pyridine
CID 4702012
8-bromo-2-(methylsulfanylmethyl)imidazo[1,2-a]pyridine
CID 117256707
2-cyclopentyl-1-methylimidazole
CID 83382106
3-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)piperidin-4-yl]-6-methyl-[1,2,4]triazolo[4,3-b]pyridazine
CID 126910111
2-(8-bromoimidazo[1,2-a]pyridin-2-yl)ethanol
CID 115044020
4-methyl-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-3-ol
CID 103897985
8-chloro-2-(pyrrolidin-1-ylmethyl)imidazo[1,2-a]pyridine
CID 117256638
1-[4-(1-methylimidazol-2-yl)piperidin-1-yl]-2-(4-phenylpiperidin-1-yl)ethanone
CID 70767253
8-bromo-2-(1-methylpiperidin-2-yl)imidazo[1,2-a]pyridine
CID 117136602
1-[[8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methyl]piperidin-4-amine
CID 82529658

Frequently Asked Questions

What is the IUPAC name of 8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine (CID 166276525) is 8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine is Cn1ccnc1C1CCN(Cc2cn3cccc(Br)c3n2)CC1.
What is the InChIKey of 8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine?
The InChIKey is UWGSAWSCAIWCNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20BrN5/c1-21-10-6-19-16(21)13-4-8-22(9-5-13)11-14-12-23-7-2-3-15(18)17(23)20-14/h2-3,6-7,10,12-13H,4-5,8-9,11H2,1H3.
What are the key properties of 8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine?
8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine has a molecular weight of 374.29 g/mol, XLogP of 3.21, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-2-[[4-(1-methylimidazol-2-yl)piperidin-1-yl]methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 166276525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).