4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol

C23H30N2O2 — CID 95212647

IUPAC4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol
SMILESC[C@@H](c1ccc(-c2ccc(C3(O)CCNCC3)cc2)cc1)N1CCOCC1
InChIInChI=1S/C23H30N2O2/c1-18(25-14-16-27-17-15-25)19-2-4-20(5-3-19)21-6-8-22(9-7-21)23(26)10-12-24-13-11-23/h2-9,18,24,26H,10-17H2,1H3/t18-/m0/s1
InChIKeyOVGSVCIVIJYHHM-SFHVURJKSA-N
MW366.51 g/mol
LogP3.32
Rot. Bonds4

About 4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol

4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol (PubChem CID 95212647) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is 4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol.

Molecular Properties

Compound Name4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol
PubChem CID95212647
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC Name4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol
SMILESC[C@@H](c1ccc(-c2ccc(C3(O)CCNCC3)cc2)cc1)N1CCOCC1
InChIInChI=1S/C23H30N2O2/c1-18(25-14-16-27-17-15-25)19-2-4-20(5-3-19)21-6-8-22(9-7-21)23(26)10-12-24-13-11-23/h2-9,18,24,26H,10-17H2,1H3/t18-/m0/s1
InChIKeyOVGSVCIVIJYHHM-SFHVURJKSA-N
XLogP3.32
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol?
The IUPAC name of 4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol (CID 95212647) is 4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol.
What is the SMILES notation for 4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol?
The canonical SMILES for 4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol is C[C@@H](c1ccc(-c2ccc(C3(O)CCNCC3)cc2)cc1)N1CCOCC1.
What is the InChIKey of 4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol?
The InChIKey is OVGSVCIVIJYHHM-SFHVURJKSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-18(25-14-16-27-17-15-25)19-2-4-20(5-3-19)21-6-8-22(9-7-21)23(26)10-12-24-13-11-23/h2-9,18,24,26H,10-17H2,1H3/t18-/m0/s1.
What are the key properties of 4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol?
4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol has a molecular weight of 366.51 g/mol, XLogP of 3.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[4-[(1S)-1-morpholin-4-ylethyl]phenyl]phenyl]piperidin-4-ol is sourced from PubChem (CID 95212647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).