3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline

C14H12BrN3 — CID 4701924

IUPAC3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
SMILESBrc1cccc(NCc2cn3ccccc3n2)c1
InChIInChI=1S/C14H12BrN3/c15-11-4-3-5-12(8-11)16-9-13-10-18-7-2-1-6-14(18)17-13/h1-8,10,16H,9H2
InChIKeyNKJFEGHCFASZTC-UHFFFAOYSA-N
MW302.18 g/mol
LogP3.71
Rot. Bonds3

About 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline

3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline (PubChem CID 4701924) has the molecular formula C14H12BrN3 and a molecular weight of 302.18 g/mol. Its IUPAC name is 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline.

Molecular Properties

Compound Name3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
PubChem CID4701924
Molecular FormulaC14H12BrN3
Molecular Weight302.18 g/mol
Exact Mass301.02
IUPAC Name3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
SMILESBrc1cccc(NCc2cn3ccccc3n2)c1
InChIInChI=1S/C14H12BrN3/c15-11-4-3-5-12(8-11)16-9-13-10-18-7-2-1-6-14(18)17-13/h1-8,10,16H,9H2
InChIKeyNKJFEGHCFASZTC-UHFFFAOYSA-N
XLogP3.71
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.18
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(imidazo[1,2-a]pyridin-2-ylmethyl)naphthalen-2-amine
CID 43400804
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methylsulfanylaniline
CID 43179471
3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzamide
CID 8917100
4-fluoro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
CID 759208
4-chloro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
CID 2967719
4-fluoro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methylaniline
CID 55118825
2-bromo-6-fluoro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
CID 103741882
N-(3-bromophenyl)-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 18096051
5-bromo-2,4-difluoro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline
CID 102847163
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-propan-2-yloxyaniline
CID 43123163
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-4-methyl-3-nitroaniline
CID 60671510
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpropan-2-amine
CID 28586618

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline?
The IUPAC name of 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline (CID 4701924) is 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline.
What is the SMILES notation for 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline?
The canonical SMILES for 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline is Brc1cccc(NCc2cn3ccccc3n2)c1.
What is the InChIKey of 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline?
The InChIKey is NKJFEGHCFASZTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrN3/c15-11-4-3-5-12(8-11)16-9-13-10-18-7-2-1-6-14(18)17-13/h1-8,10,16H,9H2.
What are the key properties of 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline?
3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline has a molecular weight of 302.18 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)aniline is sourced from PubChem (CID 4701924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).