4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine

C25H30N4O3 — CID 159654436

IUPAC4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
SMILESCOc1ncccc1CC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1
InChIInChI=1S/C25H30N4O3/c1-30-25-19(3-2-8-28-25)15-18-4-6-21(7-5-18)32-23-17-20(29-11-13-31-14-12-29)16-22-24(23)27-10-9-26-22/h2-3,8-10,16-18,21H,4-7,11-15H2,1H3
InChIKeyMRZOXKCSBFCFLK-UHFFFAOYSA-N
MW434.54 g/mol
LogP4.05
Rot. Bonds6

About 4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine

4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine (PubChem CID 159654436) has the molecular formula C25H30N4O3 and a molecular weight of 434.54 g/mol. Its IUPAC name is 4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine.

Molecular Properties

Compound Name4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
PubChem CID159654436
Molecular FormulaC25H30N4O3
Molecular Weight434.54 g/mol
Exact Mass434.23
IUPAC Name4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine
SMILESCOc1ncccc1CC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1
InChIInChI=1S/C25H30N4O3/c1-30-25-19(3-2-8-28-25)15-18-4-6-21(7-5-18)32-23-17-20(29-11-13-31-14-12-29)16-22-24(23)27-10-9-26-22/h2-3,8-10,16-18,21H,4-7,11-15H2,1H3
InChIKeyMRZOXKCSBFCFLK-UHFFFAOYSA-N
XLogP4.05
TPSA69.60 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.54
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine?
The IUPAC name of 4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine (CID 159654436) is 4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine.
What is the SMILES notation for 4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine?
The canonical SMILES for 4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine is COc1ncccc1CC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1.
What is the InChIKey of 4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine?
The InChIKey is MRZOXKCSBFCFLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N4O3/c1-30-25-19(3-2-8-28-25)15-18-4-6-21(7-5-18)32-23-17-20(29-11-13-31-14-12-29)16-22-24(23)27-10-9-26-22/h2-3,8-10,16-18,21H,4-7,11-15H2,1H3.
What are the key properties of 4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine?
4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine has a molecular weight of 434.54 g/mol, XLogP of 4.05, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[8-[4-[(2-methoxy-3-pyridinyl)methyl]cyclohexyl]oxyquinoxalin-6-yl]morpholine is sourced from PubChem (CID 159654436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).