4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine

C21H25N3O2 — CID 50970723

IUPAC4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine
SMILESCc1ccc(-c2c(-c3ccccc3)ncn2CCCN2CCOCC2)o1
InChIInChI=1S/C21H25N3O2/c1-17-8-9-19(26-17)21-20(18-6-3-2-4-7-18)22-16-24(21)11-5-10-23-12-14-25-15-13-23/h2-4,6-9,16H,5,10-15H2,1H3
InChIKeyLQYDGRYMCWIPKL-UHFFFAOYSA-N
MW351.45 g/mol
LogP3.84
Rot. Bonds6

About 4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine

4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine (PubChem CID 50970723) has the molecular formula C21H25N3O2 and a molecular weight of 351.45 g/mol. Its IUPAC name is 4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine.

Molecular Properties

Compound Name4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine
PubChem CID50970723
Molecular FormulaC21H25N3O2
Molecular Weight351.45 g/mol
Exact Mass351.19
IUPAC Name4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine
SMILESCc1ccc(-c2c(-c3ccccc3)ncn2CCCN2CCOCC2)o1
InChIInChI=1S/C21H25N3O2/c1-17-8-9-19(26-17)21-20(18-6-3-2-4-7-18)22-16-24(21)11-5-10-23-12-14-25-15-13-23/h2-4,6-9,16H,5,10-15H2,1H3
InChIKeyLQYDGRYMCWIPKL-UHFFFAOYSA-N
XLogP3.84
TPSA43.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine?
The IUPAC name of 4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine (CID 50970723) is 4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine.
What is the SMILES notation for 4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine?
The canonical SMILES for 4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine is Cc1ccc(-c2c(-c3ccccc3)ncn2CCCN2CCOCC2)o1.
What is the InChIKey of 4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine?
The InChIKey is LQYDGRYMCWIPKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O2/c1-17-8-9-19(26-17)21-20(18-6-3-2-4-7-18)22-16-24(21)11-5-10-23-12-14-25-15-13-23/h2-4,6-9,16H,5,10-15H2,1H3.
What are the key properties of 4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine?
4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine has a molecular weight of 351.45 g/mol, XLogP of 3.84, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[5-(5-methylfuran-2-yl)-4-phenylimidazol-1-yl]propyl]morpholine is sourced from PubChem (CID 50970723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).