[1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol

C12H15BrN4O — CID 23593534

IUPAC[1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol
SMILESNc1cc(N2CCCC2CO)cn2c(Br)cnc12
InChIInChI=1S/C12H15BrN4O/c13-11-5-15-12-10(14)4-9(6-17(11)12)16-3-1-2-8(16)7-18/h4-6,8,18H,1-3,7,14H2
InChIKeyCCUBUGBCGMBDIH-UHFFFAOYSA-N
MW311.18 g/mol
LogP1.64
Rot. Bonds2

About [1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol

[1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol (PubChem CID 23593534) has the molecular formula C12H15BrN4O and a molecular weight of 311.18 g/mol. Its IUPAC name is [1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol
PubChem CID23593534
Molecular FormulaC12H15BrN4O
Molecular Weight311.18 g/mol
Exact Mass310.04
IUPAC Name[1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol
SMILESNc1cc(N2CCCC2CO)cn2c(Br)cnc12
InChIInChI=1S/C12H15BrN4O/c13-11-5-15-12-10(14)4-9(6-17(11)12)16-3-1-2-8(16)7-18/h4-6,8,18H,1-3,7,14H2
InChIKeyCCUBUGBCGMBDIH-UHFFFAOYSA-N
XLogP1.64
TPSA66.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.18
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[1-[3-bromo-8-(pyridin-3-ylmethylamino)imidazo[1,2-a]pyridin-6-yl]piperidin-2-yl]methanol
CID 10476985
[1-(5-bromo-3-pyridinyl)pyrrolidin-2-yl]methanol
CID 89439842
[1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol
CID 23064302
[(2S)-1-(3-amino-4-nitrophenyl)pyrrolidin-2-yl]methanol
CID 69218686
[1-(2-amino-5-bromophenyl)piperidin-2-yl]methanol
CID 65342923
[1-(3-amino-5-methoxyphenyl)pyrrolidin-2-yl]methanol
CID 80731616
[1-(5-amino-3-bromoquinolin-8-yl)azepan-2-yl]methanol
CID 106949677
[1-(3-bromo-4-methyl-2-pyridinyl)pyrrolidin-2-yl]methanol
CID 106876337
[1-(6-aminopyrazin-2-yl)pyrrolidin-2-yl]methanol
CID 79033972
[1-(2,6-diaminopyrimidin-4-yl)pyrrolidin-2-yl]methanol
CID 80794344
[1-[5-(3-bromophenyl)pyrimidin-2-yl]pyrrolidin-2-yl]methanol
CID 116976636
[1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol
CID 114836463

Frequently Asked Questions

What is the IUPAC name of [1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol?
The IUPAC name of [1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol (CID 23593534) is [1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol is Nc1cc(N2CCCC2CO)cn2c(Br)cnc12.
What is the InChIKey of [1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol?
The InChIKey is CCUBUGBCGMBDIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15BrN4O/c13-11-5-15-12-10(14)4-9(6-17(11)12)16-3-1-2-8(16)7-18/h4-6,8,18H,1-3,7,14H2.
What are the key properties of [1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol?
[1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol has a molecular weight of 311.18 g/mol, XLogP of 1.64, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(8-amino-3-bromoimidazo[1,2-a]pyridin-6-yl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 23593534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).