N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide

C24H22BrN3O — CID 42737411

IUPACN-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide
SMILESCCCCc1ccc(C(=O)Nc2cccc(-c3cn4cc(Br)ccc4n3)c2)cc1
InChIInChI=1S/C24H22BrN3O/c1-2-3-5-17-8-10-18(11-9-17)24(29)26-21-7-4-6-19(14-21)22-16-28-15-20(25)12-13-23(28)27-22/h4,6-16H,2-3,5H2,1H3,(H,26,29)
InChIKeyRYAVLCQPRNYXMW-UHFFFAOYSA-N
MW448.36 g/mol
LogP6.36
Rot. Bonds6

About N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide

N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide (PubChem CID 42737411) has the molecular formula C24H22BrN3O and a molecular weight of 448.36 g/mol. Its IUPAC name is N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide.

Molecular Properties

Compound NameN-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide
PubChem CID42737411
Molecular FormulaC24H22BrN3O
Molecular Weight448.36 g/mol
Exact Mass447.09
IUPAC NameN-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide
SMILESCCCCc1ccc(C(=O)Nc2cccc(-c3cn4cc(Br)ccc4n3)c2)cc1
InChIInChI=1S/C24H22BrN3O/c1-2-3-5-17-8-10-18(11-9-17)24(29)26-21-7-4-6-19(14-21)22-16-28-15-20(25)12-13-23(28)27-22/h4,6-16H,2-3,5H2,1H3,(H,26,29)
InChIKeyRYAVLCQPRNYXMW-UHFFFAOYSA-N
XLogP6.36
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.36
LogP ≤ 56.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-4-hexylbenzamide
CID 42658273
4-butoxy-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 121055735
N-[3-[6-(4-methoxyphenyl)-2-pyridinyl]phenyl]-4-pentylbenzamide
CID 46090574
4-methyl-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 121028698
5-bromo-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]pyridine-3-carboxamide
CID 122284885
4-butoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 121055736
4-ethoxy-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 121028764
4-butoxy-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide
CID 7080161
N-[3-(6,8-dibromoimidazo[1,2-a]pyridin-2-yl)phenyl]pentanamide
CID 42658406
N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)-4-pentoxybenzamide
CID 122285167
4-butyl-N-[3-[2-(3-methoxyanilino)-1,3-thiazol-4-yl]phenyl]benzamide
CID 3523030
4-bromo-N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 42737491

Frequently Asked Questions

What is the IUPAC name of N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide?
The IUPAC name of N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide (CID 42737411) is N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide.
What is the SMILES notation for N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide?
The canonical SMILES for N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide is CCCCc1ccc(C(=O)Nc2cccc(-c3cn4cc(Br)ccc4n3)c2)cc1.
What is the InChIKey of N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide?
The InChIKey is RYAVLCQPRNYXMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22BrN3O/c1-2-3-5-17-8-10-18(11-9-17)24(29)26-21-7-4-6-19(14-21)22-16-28-15-20(25)12-13-23(28)27-22/h4,6-16H,2-3,5H2,1H3,(H,26,29).
What are the key properties of N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide?
N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide has a molecular weight of 448.36 g/mol, XLogP of 6.36, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenyl]-4-butylbenzamide is sourced from PubChem (CID 42737411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).