(4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone

C14H8BrF2N3O — CID 166102479

IUPAC(4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone
SMILESNc1c(F)cc(C(=O)c2cnc3c(Br)cccn23)cc1F
InChIInChI=1S/C14H8BrF2N3O/c15-8-2-1-3-20-11(6-19-14(8)20)13(21)7-4-9(16)12(18)10(17)5-7/h1-6H,18H2
InChIKeySQQPEUYBHNFOFM-UHFFFAOYSA-N
MW352.14 g/mol
LogP3.19
Rot. Bonds2

About (4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone

(4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone (PubChem CID 166102479) has the molecular formula C14H8BrF2N3O and a molecular weight of 352.14 g/mol. Its IUPAC name is (4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone.

Molecular Properties

Compound Name(4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone
PubChem CID166102479
Molecular FormulaC14H8BrF2N3O
Molecular Weight352.14 g/mol
Exact Mass350.98
IUPAC Name(4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone
SMILESNc1c(F)cc(C(=O)c2cnc3c(Br)cccn23)cc1F
InChIInChI=1S/C14H8BrF2N3O/c15-8-2-1-3-20-11(6-19-14(8)20)13(21)7-4-9(16)12(18)10(17)5-7/h1-6H,18H2
InChIKeySQQPEUYBHNFOFM-UHFFFAOYSA-N
XLogP3.19
TPSA60.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.14
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

8-fluoroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 55265827
8-bromoimidazo[1,2-a]pyridin-3-ol
CID 105466458
(E)-3-(8-bromoimidazo[1,2-a]pyridin-3-yl)prop-2-enoic acid
CID 82529321
7-bromo-8-fluoroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 178093198
8-fluoro-N'-hydroxyimidazo[1,2-a]pyridine-3-carboximidamide
CID 83878689
8-bromoimidazo[1,2-a]pyridine-3-carbaldehyde
CID 58449869
methyl 8-aminoimidazo[1,2-a]pyridine-3-carboxylate
CID 131336795
3-(aminomethyl)-N-(8-bromoimidazo[1,2-a]pyridin-3-yl)benzamide
CID 166360837
2-methyl-1-(8-methylimidazo[1,2-a]pyridin-3-yl)propan-1-one
CID 112713198
(4-amino-3,5-difluorophenyl)-[8-[2-bromo-4-[[(Z)-but-2-en-2-yl]-methylamino]-3,6-dimethylphenyl]indolizin-3-yl]methanone
CID 166102111
ethyl 8-ethoxyimidazo[1,2-a]pyridine-3-carboxylate
CID 90090238
1-(8-bromoimidazo[1,2-a]pyridin-3-yl)cyclopropan-1-amine
CID 84804181

Frequently Asked Questions

What is the IUPAC name of (4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone?
The IUPAC name of (4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone (CID 166102479) is (4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone.
What is the SMILES notation for (4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone?
The canonical SMILES for (4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone is Nc1c(F)cc(C(=O)c2cnc3c(Br)cccn23)cc1F.
What is the InChIKey of (4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone?
The InChIKey is SQQPEUYBHNFOFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8BrF2N3O/c15-8-2-1-3-20-11(6-19-14(8)20)13(21)7-4-9(16)12(18)10(17)5-7/h1-6H,18H2.
What are the key properties of (4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone?
(4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone has a molecular weight of 352.14 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-3,5-difluorophenyl)-(8-bromoimidazo[1,2-a]pyridin-3-yl)methanone is sourced from PubChem (CID 166102479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).