1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine

C15H20BrN3 — CID 84744725

IUPAC1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine
SMILESCN(C)c1ccc2c(Br)nc(C3CCCCC3)n2c1
InChIInChI=1S/C15H20BrN3/c1-18(2)12-8-9-13-14(16)17-15(19(13)10-12)11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3
InChIKeyNQKDIMYGYFTSET-UHFFFAOYSA-N
MW322.25 g/mol
LogP4.21
Rot. Bonds2

About 1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine

1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine (PubChem CID 84744725) has the molecular formula C15H20BrN3 and a molecular weight of 322.25 g/mol. Its IUPAC name is 1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine.

Molecular Properties

Compound Name1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine
PubChem CID84744725
Molecular FormulaC15H20BrN3
Molecular Weight322.25 g/mol
Exact Mass321.08
IUPAC Name1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine
SMILESCN(C)c1ccc2c(Br)nc(C3CCCCC3)n2c1
InChIInChI=1S/C15H20BrN3/c1-18(2)12-8-9-13-14(16)17-15(19(13)10-12)11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3
InChIKeyNQKDIMYGYFTSET-UHFFFAOYSA-N
XLogP4.21
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.25
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine?
The IUPAC name of 1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine (CID 84744725) is 1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine.
What is the SMILES notation for 1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine?
The canonical SMILES for 1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine is CN(C)c1ccc2c(Br)nc(C3CCCCC3)n2c1.
What is the InChIKey of 1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine?
The InChIKey is NQKDIMYGYFTSET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20BrN3/c1-18(2)12-8-9-13-14(16)17-15(19(13)10-12)11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3.
What are the key properties of 1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine?
1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine has a molecular weight of 322.25 g/mol, XLogP of 4.21, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-cyclohexyl-N,N-dimethylimidazo[1,5-a]pyridin-6-amine is sourced from PubChem (CID 84744725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).