3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine

C15H18BrN3 — CID 166210907

IUPAC3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine
SMILESCC1(C)C2CN(Cc3nc4ccccn4c3Br)CC21
InChIInChI=1S/C15H18BrN3/c1-15(2)10-7-18(8-11(10)15)9-12-14(16)19-6-4-3-5-13(19)17-12/h3-6,10-11H,7-9H2,1-2H3
InChIKeyHUQOCORUUVFHCG-UHFFFAOYSA-N
MW320.23 g/mol
LogP3.18
Rot. Bonds2

About 3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine

3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine (PubChem CID 166210907) has the molecular formula C15H18BrN3 and a molecular weight of 320.23 g/mol. Its IUPAC name is 3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine
PubChem CID166210907
Molecular FormulaC15H18BrN3
Molecular Weight320.23 g/mol
Exact Mass319.07
IUPAC Name3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine
SMILESCC1(C)C2CN(Cc3nc4ccccn4c3Br)CC21
InChIInChI=1S/C15H18BrN3/c1-15(2)10-7-18(8-11(10)15)9-12-14(16)19-6-4-3-5-13(19)17-12/h3-6,10-11H,7-9H2,1-2H3
InChIKeyHUQOCORUUVFHCG-UHFFFAOYSA-N
XLogP3.18
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.23
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine with MolForge

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Related Compounds

3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine
CID 159450021
N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide
CID 154789281
[amino-[(3-bromoimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]methylidene]azanium bromide
CID 45129671
3-bromo-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine
CID 176586103
1-[(3-bromoimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]phthalazine
CID 4277891
2-(3-bromoimidazo[1,2-a]pyridin-2-yl)-1-[3-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]piperidin-1-yl]ethanone
CID 167933281
3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-2,2-dimethylcyclobutan-1-ol
CID 81415131
2-methyl-3-[[3-(2-methylphenoxy)azetidin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 56885164
2-[3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]acetic acid
CID 82028866
2-ethylimidazo[1,2-a]pyridin-3-amine
CID 63617913
3-bromoimidazo[1,2-a]pyridine-2-carbaldehyde
CID 2748881
2-(bromomethyl)-3-chloroimidazo[1,2-a]pyridine
CID 59589453

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine (CID 166210907) is 3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine is CC1(C)C2CN(Cc3nc4ccccn4c3Br)CC21.
What is the InChIKey of 3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine?
The InChIKey is HUQOCORUUVFHCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18BrN3/c1-15(2)10-7-18(8-11(10)15)9-12-14(16)19-6-4-3-5-13(19)17-12/h3-6,10-11H,7-9H2,1-2H3.
What are the key properties of 3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine?
3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine has a molecular weight of 320.23 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 166210907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).