N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide

C14H11BrN4O — CID 69375665

IUPACN-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2nc3ncc(Br)cc3[nH]2)cc1
InChIInChI=1S/C14H11BrN4O/c1-8(20)17-11-4-2-9(3-5-11)13-18-12-6-10(15)7-16-14(12)19-13/h2-7H,1H3,(H,17,20)(H,16,18,19)
InChIKeyQINALNXGYBHQAZ-UHFFFAOYSA-N
MW331.17 g/mol
LogP3.35
Rot. Bonds2

About N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide

N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide (PubChem CID 69375665) has the molecular formula C14H11BrN4O and a molecular weight of 331.17 g/mol. Its IUPAC name is N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide
PubChem CID69375665
Molecular FormulaC14H11BrN4O
Molecular Weight331.17 g/mol
Exact Mass330.01
IUPAC NameN-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2nc3ncc(Br)cc3[nH]2)cc1
InChIInChI=1S/C14H11BrN4O/c1-8(20)17-11-4-2-9(3-5-11)13-18-12-6-10(15)7-16-14(12)19-13/h2-7H,1H3,(H,17,20)(H,16,18,19)
InChIKeyQINALNXGYBHQAZ-UHFFFAOYSA-N
XLogP3.35
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.17
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-bromo-2-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridine
CID 23025816
4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)benzonitrile
CID 54939914
[3-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)-4-chlorophenyl]carbamic acid
CID 90403447
6-bromo-2-naphthalen-2-yl-1H-imidazo[4,5-b]pyridine
CID 23025864
4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)-N-(1,3-thiazol-2-ylmethyl)aniline;bis(2,2,2-trifluoroacetic acid)
CID 87735409
1-[3-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)-4-fluorophenyl]-3-tert-butylurea
CID 90457251
4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)-N-[(2-methoxyphenyl)methyl]aniline
CID 10070065
4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)-N-(thiophen-3-ylmethyl)aniline;bis(2,2,2-trifluoroacetic acid)
CID 87736385
N-[4-(5,6-dichloro-1H-benzimidazol-2-yl)phenyl]acetamide
CID 46861752
4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)-N-[(1-methylbenzimidazol-2-yl)methyl]aniline
CID 10252276
6-bromo-2-(3-bromo-5-methylphenyl)-1H-imidazo[4,5-b]pyridine
CID 115999483
2-(4-bromophenyl)-6-chloro-1H-imidazo[4,5-b]pyridine
CID 3266811

Frequently Asked Questions

What is the IUPAC name of N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide?
The IUPAC name of N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide (CID 69375665) is N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide.
What is the SMILES notation for N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide?
The canonical SMILES for N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide is CC(=O)Nc1ccc(-c2nc3ncc(Br)cc3[nH]2)cc1.
What is the InChIKey of N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide?
The InChIKey is QINALNXGYBHQAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrN4O/c1-8(20)17-11-4-2-9(3-5-11)13-18-12-6-10(15)7-16-14(12)19-13/h2-7H,1H3,(H,17,20)(H,16,18,19).
What are the key properties of N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide?
N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide has a molecular weight of 331.17 g/mol, XLogP of 3.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]acetamide is sourced from PubChem (CID 69375665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).