2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine

C18H13BrN2O — CID 1184382

IUPAC2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine
SMILESBrc1c(OCc2cn3ccccc3n2)ccc2ccccc12
InChIInChI=1S/C18H13BrN2O/c19-18-15-6-2-1-5-13(15)8-9-16(18)22-12-14-11-21-10-4-3-7-17(21)20-14/h1-11H,12H2
InChIKeyKBFKMKCYKVPQAV-UHFFFAOYSA-N
MW353.22 g/mol
LogP4.83
Rot. Bonds3

About 2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine

2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine (PubChem CID 1184382) has the molecular formula C18H13BrN2O and a molecular weight of 353.22 g/mol. Its IUPAC name is 2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine
PubChem CID1184382
Molecular FormulaC18H13BrN2O
Molecular Weight353.22 g/mol
Exact Mass352.02
IUPAC Name2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine
SMILESBrc1c(OCc2cn3ccccc3n2)ccc2ccccc12
InChIInChI=1S/C18H13BrN2O/c19-18-15-6-2-1-5-13(15)8-9-16(18)22-12-14-11-21-10-4-3-7-17(21)20-14/h1-11H,12H2
InChIKeyKBFKMKCYKVPQAV-UHFFFAOYSA-N
XLogP4.83
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.22
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-bromo-2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine
CID 112779233
2-[(2-bromo-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
CID 28602482
5-chloro-8-(imidazo[1,2-a]pyridin-2-ylmethoxy)quinoline
CID 804228
2-(phenoxymethyl)imidazo[1,2-a]pyridine
CID 4702052
2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile
CID 7433386
2-[(2-chloro-4-methylphenoxy)methyl]imidazo[1,2-a]pyridine
CID 170746842
[3,5-dibromo-4-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]methanol
CID 107739058
4,5-dichloro-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)aniline
CID 107497897
(1R)-1-[4-bromo-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]ethanamine
CID 102946838
(1R)-1-[2-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]propan-1-ol
CID 78933268
3-bromo-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoic acid
CID 61391322
5-amino-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile
CID 61267731

Frequently Asked Questions

What is the IUPAC name of 2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine (CID 1184382) is 2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine is Brc1c(OCc2cn3ccccc3n2)ccc2ccccc12.
What is the InChIKey of 2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine?
The InChIKey is KBFKMKCYKVPQAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13BrN2O/c19-18-15-6-2-1-5-13(15)8-9-16(18)22-12-14-11-21-10-4-3-7-17(21)20-14/h1-11H,12H2.
What are the key properties of 2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine?
2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine has a molecular weight of 353.22 g/mol, XLogP of 4.83, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-bromonaphthalen-2-yl)oxymethyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 1184382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).