7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine

C14H18BrN3 — CID 117134197

IUPAC7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine
SMILESCC(C)N1CCCC1c1cn2ccc(Br)cc2n1
InChIInChI=1S/C14H18BrN3/c1-10(2)18-6-3-4-13(18)12-9-17-7-5-11(15)8-14(17)16-12/h5,7-10,13H,3-4,6H2,1-2H3
InChIKeyHCRPMNIAJSZUCP-UHFFFAOYSA-N
MW308.22 g/mol
LogP3.64
Rot. Bonds2

About 7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine

7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine (PubChem CID 117134197) has the molecular formula C14H18BrN3 and a molecular weight of 308.22 g/mol. Its IUPAC name is 7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine
PubChem CID117134197
Molecular FormulaC14H18BrN3
Molecular Weight308.22 g/mol
Exact Mass307.07
IUPAC Name7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine
SMILESCC(C)N1CCCC1c1cn2ccc(Br)cc2n1
InChIInChI=1S/C14H18BrN3/c1-10(2)18-6-3-4-13(18)12-9-17-7-5-11(15)8-14(17)16-12/h5,7-10,13H,3-4,6H2,1-2H3
InChIKeyHCRPMNIAJSZUCP-UHFFFAOYSA-N
XLogP3.64
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.22
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridin-7-amine
CID 117134191
7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117134207
2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridin-8-amine
CID 117136485
[2-(1-propan-2-ylpiperidin-2-yl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 117129618
7-methyl-2-(1-methylpyrrolidin-2-yl)imidazo[1,2-a]pyridine
CID 117134175
7-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine
CID 117133635
7-methoxy-2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]imidazo[1,2-a]pyridine
CID 117134376
(2R)-2-(2,5-difluorophenyl)-1-propan-2-ylpyrrolidine
CID 166802320
N-[(7-bromoimidazo[1,2-a]pyridin-2-yl)methyl]cyclopropanamine
CID 117256313
1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol
CID 95825122
2-methyl-4-(1-propan-2-ylpyrrolidin-2-yl)-1H-pyrimidin-6-one
CID 136804068
2-(1-ethylpiperidin-2-yl)imidazo[1,2-a]pyridine-7-carboxylic acid
CID 117134358

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine (CID 117134197) is 7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine is CC(C)N1CCCC1c1cn2ccc(Br)cc2n1.
What is the InChIKey of 7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine?
The InChIKey is HCRPMNIAJSZUCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18BrN3/c1-10(2)18-6-3-4-13(18)12-9-17-7-5-11(15)8-14(17)16-12/h5,7-10,13H,3-4,6H2,1-2H3.
What are the key properties of 7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine?
7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine has a molecular weight of 308.22 g/mol, XLogP of 3.64, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2-(1-propan-2-ylpyrrolidin-2-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 117134197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).