6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine

C17H16BrClN2 — CID 51361296

IUPAC6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine
SMILESCCCc1nc2ccc(Br)cn2c1Cc1cccc(Cl)c1
InChIInChI=1S/C17H16BrClN2/c1-2-4-15-16(10-12-5-3-6-14(19)9-12)21-11-13(18)7-8-17(21)20-15/h3,5-9,11H,2,4,10H2,1H3
InChIKeyAWBLQBFMBWDOLN-UHFFFAOYSA-N
MW363.69 g/mol
LogP5.29
Rot. Bonds4

About 6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine

6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine (PubChem CID 51361296) has the molecular formula C17H16BrClN2 and a molecular weight of 363.69 g/mol. Its IUPAC name is 6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine
PubChem CID51361296
Molecular FormulaC17H16BrClN2
Molecular Weight363.69 g/mol
Exact Mass362.02
IUPAC Name6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine
SMILESCCCc1nc2ccc(Br)cn2c1Cc1cccc(Cl)c1
InChIInChI=1S/C17H16BrClN2/c1-2-4-15-16(10-12-5-3-6-14(19)9-12)21-11-13(18)7-8-17(21)20-15/h3,5-9,11H,2,4,10H2,1H3
InChIKeyAWBLQBFMBWDOLN-UHFFFAOYSA-N
XLogP5.29
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.69
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

CID 3058746
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CID 623416
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CID 667720
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CID 745769
CID 745769
CID 2757120
CID 2757120
CID 58880626
CID 58880626
CID 837893
CID 837893
CID 201136
CID 201136
CID 5329339
CID 5329339
CID 10506326
CID 10506326
CID 18001593
CID 18001593
CID 24744270
CID 24744270

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine (CID 51361296) is 6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine is CCCc1nc2ccc(Br)cn2c1Cc1cccc(Cl)c1.
What is the InChIKey of 6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine?
The InChIKey is AWBLQBFMBWDOLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16BrClN2/c1-2-4-15-16(10-12-5-3-6-14(19)9-12)21-11-13(18)7-8-17(21)20-15/h3,5-9,11H,2,4,10H2,1H3.
What are the key properties of 6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine?
6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine has a molecular weight of 363.69 g/mol, XLogP of 5.29, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-[(3-chlorophenyl)methyl]-2-propylimidazo[1,2-a]pyridine is sourced from PubChem (CID 51361296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).