4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine

C19H19N3O — CID 3233628

IUPAC4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine
SMILESCc1ccccc1-c1nc(N2CCOCC2)c2ccccc2n1
InChIInChI=1S/C19H19N3O/c1-14-6-2-3-7-15(14)18-20-17-9-5-4-8-16(17)19(21-18)22-10-12-23-13-11-22/h2-9H,10-13H2,1H3
InChIKeyKXWUGNUOMQLLRQ-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.44
Rot. Bonds2

About 4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine

4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine (PubChem CID 3233628) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine.

Molecular Properties

Compound Name4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine
PubChem CID3233628
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine
SMILESCc1ccccc1-c1nc(N2CCOCC2)c2ccccc2n1
InChIInChI=1S/C19H19N3O/c1-14-6-2-3-7-15(14)18-20-17-9-5-4-8-16(17)19(21-18)22-10-12-23-13-11-22/h2-9H,10-13H2,1H3
InChIKeyKXWUGNUOMQLLRQ-UHFFFAOYSA-N
XLogP3.44
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine?
The IUPAC name of 4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine (CID 3233628) is 4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine.
What is the SMILES notation for 4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine?
The canonical SMILES for 4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine is Cc1ccccc1-c1nc(N2CCOCC2)c2ccccc2n1.
What is the InChIKey of 4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine?
The InChIKey is KXWUGNUOMQLLRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-14-6-2-3-7-15(14)18-20-17-9-5-4-8-16(17)19(21-18)22-10-12-23-13-11-22/h2-9H,10-13H2,1H3.
What are the key properties of 4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine?
4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine has a molecular weight of 305.38 g/mol, XLogP of 3.44, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methylphenyl)quinazolin-4-yl]morpholine is sourced from PubChem (CID 3233628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).