2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine

C15H13ClFN3O — CID 63880063

IUPAC2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine
SMILESNCCc1c(Oc2ccc(F)c(Cl)c2)nc2ccccn12
InChIInChI=1S/C15H13ClFN3O/c16-11-9-10(4-5-12(11)17)21-15-13(6-7-18)20-8-2-1-3-14(20)19-15/h1-5,8-9H,6-7,18H2
InChIKeyBPPOXXOJOJEBGI-UHFFFAOYSA-N
MW305.74 g/mol
LogP3.42
Rot. Bonds4

About 2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine

2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine (PubChem CID 63880063) has the molecular formula C15H13ClFN3O and a molecular weight of 305.74 g/mol. Its IUPAC name is 2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine
PubChem CID63880063
Molecular FormulaC15H13ClFN3O
Molecular Weight305.74 g/mol
Exact Mass305.07
IUPAC Name2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine
SMILESNCCc1c(Oc2ccc(F)c(Cl)c2)nc2ccccn12
InChIInChI=1S/C15H13ClFN3O/c16-11-9-10(4-5-12(11)17)21-15-13(6-7-18)20-8-2-1-3-14(20)19-15/h1-5,8-9H,6-7,18H2
InChIKeyBPPOXXOJOJEBGI-UHFFFAOYSA-N
XLogP3.42
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.74
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-Chloro-8-(2,6-dichlorobenzyloxy)-2-methylimidazo[1,2-a]pyridine
CID 10569271
8-(Benzyloxy)-2-methylimidazo[1,2-a]pyridin-3-amine
CID 13900258
N-(azetidin-3-yl)-6-(6-chloro-8-methoxyimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine
CID 73265220
6-chloro-N-(4-methoxyphenyl)-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
CID 4159072
6-Chloro-3-{[4-(2-methoxyphenyl)piperazino]methyl}imidazo[1,2-a]pyridine
CID 16413575
6-Chloro-3-[2-(4-fluorophenoxy)ethoxy]-2-phenyl-imidazo[1,2-a]pyridine
CID 137637246
6-Chloro-3-(3-phenoxypropoxy)-2-phenyl-imidazo[1,2-a]pyridine
CID 137642608
3-Chloro-8-(2,6-difluoro-benzyloxy)-2-methyl-imidazo[1,2-a]pyridine
CID 10518915
8-(2,6-Dichloro-benzyloxy)-2-ethyl-imidazo[1,2-a]pyridine
CID 10663541
3-Bromo-8-(2-chloro-6-fluoro-benzyloxy)-2-methyl-imidazo[1,2-a]pyridine
CID 10737855
8-(2,6-Dichlorobenzyloxy)-2-methylimidazo[1,2-a]pyridine
CID 10852230
[2-[6-Chloro-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-4,5-dihydro-1,3-oxazol-5-yl]methanamine
CID 162763696

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine?
The IUPAC name of 2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine (CID 63880063) is 2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine.
What is the SMILES notation for 2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine?
The canonical SMILES for 2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine is NCCc1c(Oc2ccc(F)c(Cl)c2)nc2ccccn12.
What is the InChIKey of 2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine?
The InChIKey is BPPOXXOJOJEBGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFN3O/c16-11-9-10(4-5-12(11)17)21-15-13(6-7-18)20-8-2-1-3-14(20)19-15/h1-5,8-9H,6-7,18H2.
What are the key properties of 2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine?
2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine has a molecular weight of 305.74 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-chloro-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine is sourced from PubChem (CID 63880063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).