6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine

C19H19BrFN3 — CID 4589362

IUPAC6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine
SMILESFc1cccc(-c2nc3ccc(Br)cn3c2NC2CCCCC2)c1
InChIInChI=1S/C19H19BrFN3/c20-14-9-10-17-23-18(13-5-4-6-15(21)11-13)19(24(17)12-14)22-16-7-2-1-3-8-16/h4-6,9-12,16,22H,1-3,7-8H2
InChIKeyZFMMNOGPVYDBCF-UHFFFAOYSA-N
MW388.28 g/mol
LogP5.65
Rot. Bonds3

About 6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine

6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 4589362) has the molecular formula C19H19BrFN3 and a molecular weight of 388.28 g/mol. Its IUPAC name is 6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID4589362
Molecular FormulaC19H19BrFN3
Molecular Weight388.28 g/mol
Exact Mass387.07
IUPAC Name6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine
SMILESFc1cccc(-c2nc3ccc(Br)cn3c2NC2CCCCC2)c1
InChIInChI=1S/C19H19BrFN3/c20-14-9-10-17-23-18(13-5-4-6-15(21)11-13)19(24(17)12-14)22-16-7-2-1-3-8-16/h4-6,9-12,16,22H,1-3,7-8H2
InChIKeyZFMMNOGPVYDBCF-UHFFFAOYSA-N
XLogP5.65
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.28
LogP ≤ 55.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine (CID 4589362) is 6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine is Fc1cccc(-c2nc3ccc(Br)cn3c2NC2CCCCC2)c1.
What is the InChIKey of 6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is ZFMMNOGPVYDBCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19BrFN3/c20-14-9-10-17-23-18(13-5-4-6-15(21)11-13)19(24(17)12-14)22-16-7-2-1-3-8-16/h4-6,9-12,16,22H,1-3,7-8H2.
What are the key properties of 6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine?
6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 388.28 g/mol, XLogP of 5.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-cyclohexyl-2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 4589362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).