4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine

C19H19N3O2 — CID 3233812

IUPAC4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine
SMILESCOc1ccccc1-c1ccc2ncnc(N3CCOCC3)c2c1
InChIInChI=1S/C19H19N3O2/c1-23-18-5-3-2-4-15(18)14-6-7-17-16(12-14)19(21-13-20-17)22-8-10-24-11-9-22/h2-7,12-13H,8-11H2,1H3
InChIKeyJCTMVLMTEATXTB-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.14
Rot. Bonds3

About 4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine

4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine (PubChem CID 3233812) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine.

Molecular Properties

Compound Name4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine
PubChem CID3233812
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine
SMILESCOc1ccccc1-c1ccc2ncnc(N3CCOCC3)c2c1
InChIInChI=1S/C19H19N3O2/c1-23-18-5-3-2-4-15(18)14-6-7-17-16(12-14)19(21-13-20-17)22-8-10-24-11-9-22/h2-7,12-13H,8-11H2,1H3
InChIKeyJCTMVLMTEATXTB-UHFFFAOYSA-N
XLogP3.14
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine?
The IUPAC name of 4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine (CID 3233812) is 4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine.
What is the SMILES notation for 4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine?
The canonical SMILES for 4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine is COc1ccccc1-c1ccc2ncnc(N3CCOCC3)c2c1.
What is the InChIKey of 4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine?
The InChIKey is JCTMVLMTEATXTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-23-18-5-3-2-4-15(18)14-6-7-17-16(12-14)19(21-13-20-17)22-8-10-24-11-9-22/h2-7,12-13H,8-11H2,1H3.
What are the key properties of 4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine?
4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine has a molecular weight of 321.38 g/mol, XLogP of 3.14, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(2-methoxyphenyl)quinazolin-4-yl]morpholine is sourced from PubChem (CID 3233812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).