[6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone

C20H22FN3O3 — CID 95561255

IUPAC[6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(N2CCO[C@H](c3ccc(F)cc3)C2)nc1)N1CCOCC1
InChIInChI=1S/C20H22FN3O3/c21-17-4-1-15(2-5-17)18-14-24(9-12-27-18)19-6-3-16(13-22-19)20(25)23-7-10-26-11-8-23/h1-6,13,18H,7-12,14H2/t18-/m0/s1
InChIKeyLEFVZJKATZGDPF-SFHVURJKSA-N
MW371.41 g/mol
LogP2.27
Rot. Bonds3

About [6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone

[6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone (PubChem CID 95561255) has the molecular formula C20H22FN3O3 and a molecular weight of 371.41 g/mol. Its IUPAC name is [6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone
PubChem CID95561255
Molecular FormulaC20H22FN3O3
Molecular Weight371.41 g/mol
Exact Mass371.16
IUPAC Name[6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(N2CCO[C@H](c3ccc(F)cc3)C2)nc1)N1CCOCC1
InChIInChI=1S/C20H22FN3O3/c21-17-4-1-15(2-5-17)18-14-24(9-12-27-18)19-6-3-16(13-22-19)20(25)23-7-10-26-11-8-23/h1-6,13,18H,7-12,14H2/t18-/m0/s1
InChIKeyLEFVZJKATZGDPF-SFHVURJKSA-N
XLogP2.27
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.41
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone?
The IUPAC name of [6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone (CID 95561255) is [6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone?
The canonical SMILES for [6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone is O=C(c1ccc(N2CCO[C@H](c3ccc(F)cc3)C2)nc1)N1CCOCC1.
What is the InChIKey of [6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone?
The InChIKey is LEFVZJKATZGDPF-SFHVURJKSA-N. The full InChI is InChI=1S/C20H22FN3O3/c21-17-4-1-15(2-5-17)18-14-24(9-12-27-18)19-6-3-16(13-22-19)20(25)23-7-10-26-11-8-23/h1-6,13,18H,7-12,14H2/t18-/m0/s1.
What are the key properties of [6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone?
[6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone has a molecular weight of 371.41 g/mol, XLogP of 2.27, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 95561255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).