1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine

C16H16BrN3 — CID 84744883

IUPAC1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine
SMILESCc1ccccc1-c1nc(Br)c2ccc(N(C)C)cn12
InChIInChI=1S/C16H16BrN3/c1-11-6-4-5-7-13(11)16-18-15(17)14-9-8-12(19(2)3)10-20(14)16/h4-10H,1-3H3
InChIKeyIDCZWTDGWBESJA-UHFFFAOYSA-N
MW330.23 g/mol
LogP4.14
Rot. Bonds2

About 1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine

1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine (PubChem CID 84744883) has the molecular formula C16H16BrN3 and a molecular weight of 330.23 g/mol. Its IUPAC name is 1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine.

Molecular Properties

Compound Name1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine
PubChem CID84744883
Molecular FormulaC16H16BrN3
Molecular Weight330.23 g/mol
Exact Mass329.05
IUPAC Name1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine
SMILESCc1ccccc1-c1nc(Br)c2ccc(N(C)C)cn12
InChIInChI=1S/C16H16BrN3/c1-11-6-4-5-7-13(11)16-18-15(17)14-9-8-12(19(2)3)10-20(14)16/h4-10H,1-3H3
InChIKeyIDCZWTDGWBESJA-UHFFFAOYSA-N
XLogP4.14
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.23
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine?
The IUPAC name of 1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine (CID 84744883) is 1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine.
What is the SMILES notation for 1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine?
The canonical SMILES for 1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine is Cc1ccccc1-c1nc(Br)c2ccc(N(C)C)cn12.
What is the InChIKey of 1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine?
The InChIKey is IDCZWTDGWBESJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16BrN3/c1-11-6-4-5-7-13(11)16-18-15(17)14-9-8-12(19(2)3)10-20(14)16/h4-10H,1-3H3.
What are the key properties of 1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine?
1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine has a molecular weight of 330.23 g/mol, XLogP of 4.14, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-N,N-dimethyl-3-(2-methylphenyl)imidazo[1,5-a]pyridin-6-amine is sourced from PubChem (CID 84744883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).