N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine

C20H22Cl2N4O — CID 24849872

IUPACN-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine
SMILESCCNCc1cc2ncc(N3CCOCC3)n2cc1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C20H22Cl2N4O/c1-2-23-11-14-9-19-24-12-20(25-5-7-27-8-6-25)26(19)13-17(14)16-4-3-15(21)10-18(16)22/h3-4,9-10,12-13,23H,2,5-8,11H2,1H3
InChIKeyUNCCLSZQQDOADK-UHFFFAOYSA-N
MW405.33 g/mol
LogP4.25
Rot. Bonds5

About N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine

N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine (PubChem CID 24849872) has the molecular formula C20H22Cl2N4O and a molecular weight of 405.33 g/mol. Its IUPAC name is N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine
PubChem CID24849872
Molecular FormulaC20H22Cl2N4O
Molecular Weight405.33 g/mol
Exact Mass404.12
IUPAC NameN-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine
SMILESCCNCc1cc2ncc(N3CCOCC3)n2cc1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C20H22Cl2N4O/c1-2-23-11-14-9-19-24-12-20(25-5-7-27-8-6-25)26(19)13-17(14)16-4-3-15(21)10-18(16)22/h3-4,9-10,12-13,23H,2,5-8,11H2,1H3
InChIKeyUNCCLSZQQDOADK-UHFFFAOYSA-N
XLogP4.25
TPSA41.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.33
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine?
The IUPAC name of N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine (CID 24849872) is N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine.
What is the SMILES notation for N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine?
The canonical SMILES for N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine is CCNCc1cc2ncc(N3CCOCC3)n2cc1-c1ccc(Cl)cc1Cl.
What is the InChIKey of N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine?
The InChIKey is UNCCLSZQQDOADK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22Cl2N4O/c1-2-23-11-14-9-19-24-12-20(25-5-7-27-8-6-25)26(19)13-17(14)16-4-3-15(21)10-18(16)22/h3-4,9-10,12-13,23H,2,5-8,11H2,1H3.
What are the key properties of N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine?
N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine has a molecular weight of 405.33 g/mol, XLogP of 4.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(2,4-dichlorophenyl)-3-morpholin-4-ylimidazo[1,2-a]pyridin-7-yl]methyl]ethanamine is sourced from PubChem (CID 24849872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).