2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine

C14H13BrN4 — CID 79821265

IUPAC2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCN(C)c1ccc2[nH]c(-c3ccccc3Br)nc2n1
InChIInChI=1S/C14H13BrN4/c1-19(2)12-8-7-11-14(17-12)18-13(16-11)9-5-3-4-6-10(9)15/h3-8H,1-2H3,(H,16,17,18)
InChIKeyKRSYZJCDWPKVNY-UHFFFAOYSA-N
MW317.19 g/mol
LogP3.45
Rot. Bonds2

About 2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine

2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine (PubChem CID 79821265) has the molecular formula C14H13BrN4 and a molecular weight of 317.19 g/mol. Its IUPAC name is 2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
PubChem CID79821265
Molecular FormulaC14H13BrN4
Molecular Weight317.19 g/mol
Exact Mass316.03
IUPAC Name2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCN(C)c1ccc2[nH]c(-c3ccccc3Br)nc2n1
InChIInChI=1S/C14H13BrN4/c1-19(2)12-8-7-11-14(17-12)18-13(16-11)9-5-3-4-6-10(9)15/h3-8H,1-2H3,(H,16,17,18)
InChIKeyKRSYZJCDWPKVNY-UHFFFAOYSA-N
XLogP3.45
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.19
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-amino-3-chlorophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 107049984
2-(2-amino-5-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 79816424
2-(2,5-dimethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821345
2-tert-butyl-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 79816441
2-(furan-3-yl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821436
2-(4-ethylphenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821611
4-chloro-3-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol
CID 106502361
2-(2-chloro-6-fluorophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821953
2-(3,4-difluorophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 79820763
2-(3-bromo-2-chlorophenyl)-5-methyl-1H-imidazo[4,5-b]pyridine
CID 113403041
N,N-dimethyl-2-[(2-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridin-5-amine
CID 79816370
2-(5-fluoro-2-pyridinyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 104639118

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine?
The IUPAC name of 2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine (CID 79821265) is 2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine?
The canonical SMILES for 2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine is CN(C)c1ccc2[nH]c(-c3ccccc3Br)nc2n1.
What is the InChIKey of 2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine?
The InChIKey is KRSYZJCDWPKVNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrN4/c1-19(2)12-8-7-11-14(17-12)18-13(16-11)9-5-3-4-6-10(9)15/h3-8H,1-2H3,(H,16,17,18).
What are the key properties of 2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine?
2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine has a molecular weight of 317.19 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-N,N-dimethyl-1H-imidazo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 79821265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).