N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline

C14H12ClN3 — CID 78912513

IUPACN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline
SMILESClc1ccc2nc(CNc3ccccc3)cn2c1
InChIInChI=1S/C14H12ClN3/c15-11-6-7-14-17-13(10-18(14)9-11)8-16-12-4-2-1-3-5-12/h1-7,9-10,16H,8H2
InChIKeyUIWIPTRIJPRABW-UHFFFAOYSA-N
MW257.72 g/mol
LogP3.60
Rot. Bonds3

About N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline

N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline (PubChem CID 78912513) has the molecular formula C14H12ClN3 and a molecular weight of 257.72 g/mol. Its IUPAC name is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline.

Molecular Properties

Compound NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline
PubChem CID78912513
Molecular FormulaC14H12ClN3
Molecular Weight257.72 g/mol
Exact Mass257.07
IUPAC NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline
SMILESClc1ccc2nc(CNc3ccccc3)cn2c1
InChIInChI=1S/C14H12ClN3/c15-11-6-7-14-17-13(10-18(14)9-11)8-16-12-4-2-1-3-5-12/h1-7,9-10,16H,8H2
InChIKeyUIWIPTRIJPRABW-UHFFFAOYSA-N
XLogP3.60
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.72
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline?
The IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline (CID 78912513) is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline.
What is the SMILES notation for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline?
The canonical SMILES for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline is Clc1ccc2nc(CNc3ccccc3)cn2c1.
What is the InChIKey of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline?
The InChIKey is UIWIPTRIJPRABW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3/c15-11-6-7-14-17-13(10-18(14)9-11)8-16-12-4-2-1-3-5-12/h1-7,9-10,16H,8H2.
What are the key properties of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline?
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline has a molecular weight of 257.72 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline is sourced from PubChem (CID 78912513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).