2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one

C25H30N2O5 — CID 1111362

IUPAC2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one
SMILESO=C1c2cc(OCCN3CCOCC3)ccc2-c2ccc(OCCN3CCOCC3)cc21
InChIInChI=1S/C25H30N2O5/c28-25-23-17-19(31-15-9-26-5-11-29-12-6-26)1-3-21(23)22-4-2-20(18-24(22)25)32-16-10-27-7-13-30-14-8-27/h1-4,17-18H,5-16H2
InChIKeyHXZYDWIICVVQAR-UHFFFAOYSA-N
MW438.52 g/mol
LogP2.32
Rot. Bonds8

About 2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one

2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one (PubChem CID 1111362) has the molecular formula C25H30N2O5 and a molecular weight of 438.52 g/mol. Its IUPAC name is 2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one.

Molecular Properties

Compound Name2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one
PubChem CID1111362
Molecular FormulaC25H30N2O5
Molecular Weight438.52 g/mol
Exact Mass438.22
IUPAC Name2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one
SMILESO=C1c2cc(OCCN3CCOCC3)ccc2-c2ccc(OCCN3CCOCC3)cc21
InChIInChI=1S/C25H30N2O5/c28-25-23-17-19(31-15-9-26-5-11-29-12-6-26)1-3-21(23)22-4-2-20(18-24(22)25)32-16-10-27-7-13-30-14-8-27/h1-4,17-18H,5-16H2
InChIKeyHXZYDWIICVVQAR-UHFFFAOYSA-N
XLogP2.32
TPSA60.47 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.52
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one?
The IUPAC name of 2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one (CID 1111362) is 2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one.
What is the SMILES notation for 2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one?
The canonical SMILES for 2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one is O=C1c2cc(OCCN3CCOCC3)ccc2-c2ccc(OCCN3CCOCC3)cc21.
What is the InChIKey of 2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one?
The InChIKey is HXZYDWIICVVQAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N2O5/c28-25-23-17-19(31-15-9-26-5-11-29-12-6-26)1-3-21(23)22-4-2-20(18-24(22)25)32-16-10-27-7-13-30-14-8-27/h1-4,17-18H,5-16H2.
What are the key properties of 2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one?
2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one has a molecular weight of 438.52 g/mol, XLogP of 2.32, 8 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-bis(2-morpholin-4-ylethoxy)fluoren-9-one is sourced from PubChem (CID 1111362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).