4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine

C23H23N5O2 — CID 71203902

IUPAC4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine
SMILESCn1cc(-c2ccccc2)nc1COc1nc(N2CCOCC2)c2ccccc2n1
InChIInChI=1S/C23H23N5O2/c1-27-15-20(17-7-3-2-4-8-17)24-21(27)16-30-23-25-19-10-6-5-9-18(19)22(26-23)28-11-13-29-14-12-28/h2-10,15H,11-14,16H2,1H3
InChIKeyVYLUKKSLJOSSKV-UHFFFAOYSA-N
MW401.47 g/mol
LogP3.45
Rot. Bonds5

About 4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine

4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine (PubChem CID 71203902) has the molecular formula C23H23N5O2 and a molecular weight of 401.47 g/mol. Its IUPAC name is 4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine.

Molecular Properties

Compound Name4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine
PubChem CID71203902
Molecular FormulaC23H23N5O2
Molecular Weight401.47 g/mol
Exact Mass401.19
IUPAC Name4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine
SMILESCn1cc(-c2ccccc2)nc1COc1nc(N2CCOCC2)c2ccccc2n1
InChIInChI=1S/C23H23N5O2/c1-27-15-20(17-7-3-2-4-8-17)24-21(27)16-30-23-25-19-10-6-5-9-18(19)22(26-23)28-11-13-29-14-12-28/h2-10,15H,11-14,16H2,1H3
InChIKeyVYLUKKSLJOSSKV-UHFFFAOYSA-N
XLogP3.45
TPSA65.30 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.47
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine?
The IUPAC name of 4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine (CID 71203902) is 4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine.
What is the SMILES notation for 4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine?
The canonical SMILES for 4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine is Cn1cc(-c2ccccc2)nc1COc1nc(N2CCOCC2)c2ccccc2n1.
What is the InChIKey of 4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine?
The InChIKey is VYLUKKSLJOSSKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O2/c1-27-15-20(17-7-3-2-4-8-17)24-21(27)16-30-23-25-19-10-6-5-9-18(19)22(26-23)28-11-13-29-14-12-28/h2-10,15H,11-14,16H2,1H3.
What are the key properties of 4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine?
4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine has a molecular weight of 401.47 g/mol, XLogP of 3.45, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazolin-4-yl]morpholine is sourced from PubChem (CID 71203902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).