N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide

C18H17Br2N3O — CID 42658406

IUPACN-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide
SMILESCCCCC(=O)Nc1cccc(-c2cn3cc(Br)cc(Br)c3n2)c1
InChIInChI=1S/C18H17Br2N3O/c1-2-3-7-17(24)21-14-6-4-5-12(8-14)16-11-23-10-13(19)9-15(20)18(23)22-16/h4-6,8-11H,2-3,7H2,1H3,(H,21,24)
InChIKeyQSNYZUNNJRBSGF-UHFFFAOYSA-N
MW451.16 g/mol
LogP5.66
Rot. Bonds5

About N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide

N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide (PubChem CID 42658406) has the molecular formula C18H17Br2N3O and a molecular weight of 451.16 g/mol. Its IUPAC name is N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide.

Molecular Properties

Compound NameN-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide
PubChem CID42658406
Molecular FormulaC18H17Br2N3O
Molecular Weight451.16 g/mol
Exact Mass448.97
IUPAC NameN-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide
SMILESCCCCC(=O)Nc1cccc(-c2cn3cc(Br)cc(Br)c3n2)c1
InChIInChI=1S/C18H17Br2N3O/c1-2-3-7-17(24)21-14-6-4-5-12(8-14)16-11-23-10-13(19)9-15(20)18(23)22-16/h4-6,8-11H,2-3,7H2,1H3,(H,21,24)
InChIKeyQSNYZUNNJRBSGF-UHFFFAOYSA-N
XLogP5.66
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.16
LogP ≤ 55.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
CID 42658403
N-[4-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide
CID 42658389
N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]-3-methoxybenzamide
CID 42737775
N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pentanamide
CID 7151267
N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]-1,3-benzodioxole-5-carboxamide
CID 42737773
N-(3-bromophenyl)heptanamide
CID 4596383
N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]-2,4,6-trimethylbenzenesulfonamide
CID 42737783
N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide
CID 42737411
2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
CID 42737754
N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]octanamide
CID 60552910
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide
CID 877528
N-[3-[[3-(hexanoylamino)phenyl]methyl]phenyl]hexanamide
CID 101187552

Frequently Asked Questions

What is the IUPAC name of N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide?
The IUPAC name of N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide (CID 42658406) is N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide.
What is the SMILES notation for N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide?
The canonical SMILES for N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide is CCCCC(=O)Nc1cccc(-c2cn3cc(Br)cc(Br)c3n2)c1.
What is the InChIKey of N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide?
The InChIKey is QSNYZUNNJRBSGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17Br2N3O/c1-2-3-7-17(24)21-14-6-4-5-12(8-14)16-11-23-10-13(19)9-15(20)18(23)22-16/h4-6,8-11H,2-3,7H2,1H3,(H,21,24).
What are the key properties of N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide?
N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide has a molecular weight of 451.16 g/mol, XLogP of 5.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide is sourced from PubChem (CID 42658406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).