4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine

C16H24N2O3 — CID 609793

IUPAC4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine
SMILESCOc1ccc(C(N2CCOCC2)N2CCOCC2)cc1
InChIInChI=1S/C16H24N2O3/c1-19-15-4-2-14(3-5-15)16(17-6-10-20-11-7-17)18-8-12-21-13-9-18/h2-5,16H,6-13H2,1H3
InChIKeyYNCWTAAYDVBKHK-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.36
Rot. Bonds4

About 4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine

4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine (PubChem CID 609793) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine.

Molecular Properties

Compound Name4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine
PubChem CID609793
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine
SMILESCOc1ccc(C(N2CCOCC2)N2CCOCC2)cc1
InChIInChI=1S/C16H24N2O3/c1-19-15-4-2-14(3-5-15)16(17-6-10-20-11-7-17)18-8-12-21-13-9-18/h2-5,16H,6-13H2,1H3
InChIKeyYNCWTAAYDVBKHK-UHFFFAOYSA-N
XLogP1.36
TPSA34.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine?
The IUPAC name of 4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine (CID 609793) is 4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine.
What is the SMILES notation for 4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine?
The canonical SMILES for 4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine is COc1ccc(C(N2CCOCC2)N2CCOCC2)cc1.
What is the InChIKey of 4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine?
The InChIKey is YNCWTAAYDVBKHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-19-15-4-2-14(3-5-15)16(17-6-10-20-11-7-17)18-8-12-21-13-9-18/h2-5,16H,6-13H2,1H3.
What are the key properties of 4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine?
4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine has a molecular weight of 292.38 g/mol, XLogP of 1.36, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methoxyphenyl)-morpholin-4-ylmethyl]morpholine is sourced from PubChem (CID 609793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).