[6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone

C18H19F2N3O2 — CID 46081029

IUPAC[6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone
SMILESO=C(c1cn2c(n1)CCC(c1cc(F)ccc1F)C2)N1CCOCC1
InChIInChI=1S/C18H19F2N3O2/c19-13-2-3-15(20)14(9-13)12-1-4-17-21-16(11-23(17)10-12)18(24)22-5-7-25-8-6-22/h2-3,9,11-12H,1,4-8,10H2
InChIKeyRWKDYAMQSBAZQM-UHFFFAOYSA-N
MW347.37 g/mol
LogP2.36
Rot. Bonds2

About [6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone

[6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone (PubChem CID 46081029) has the molecular formula C18H19F2N3O2 and a molecular weight of 347.37 g/mol. Its IUPAC name is [6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone
PubChem CID46081029
Molecular FormulaC18H19F2N3O2
Molecular Weight347.37 g/mol
Exact Mass347.14
IUPAC Name[6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone
SMILESO=C(c1cn2c(n1)CCC(c1cc(F)ccc1F)C2)N1CCOCC1
InChIInChI=1S/C18H19F2N3O2/c19-13-2-3-15(20)14(9-13)12-1-4-17-21-16(11-23(17)10-12)18(24)22-5-7-25-8-6-22/h2-3,9,11-12H,1,4-8,10H2
InChIKeyRWKDYAMQSBAZQM-UHFFFAOYSA-N
XLogP2.36
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.37
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone?
The IUPAC name of [6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone (CID 46081029) is [6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone is O=C(c1cn2c(n1)CCC(c1cc(F)ccc1F)C2)N1CCOCC1.
What is the InChIKey of [6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone?
The InChIKey is RWKDYAMQSBAZQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F2N3O2/c19-13-2-3-15(20)14(9-13)12-1-4-17-21-16(11-23(17)10-12)18(24)22-5-7-25-8-6-22/h2-3,9,11-12H,1,4-8,10H2.
What are the key properties of [6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone?
[6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone has a molecular weight of 347.37 g/mol, XLogP of 2.36, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,5-difluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 46081029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).