4-(2-pyridin-3-ylquinazolin-4-yl)morpholine

C17H16N4O — CID 872410

IUPAC4-(2-pyridin-3-ylquinazolin-4-yl)morpholine
SMILESc1cncc(-c2nc(N3CCOCC3)c3ccccc3n2)c1
InChIInChI=1S/C17H16N4O/c1-2-6-15-14(5-1)17(21-8-10-22-11-9-21)20-16(19-15)13-4-3-7-18-12-13/h1-7,12H,8-11H2
InChIKeyDHGJMRBQLPLBGN-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.53
Rot. Bonds2

About 4-(2-pyridin-3-ylquinazolin-4-yl)morpholine

4-(2-pyridin-3-ylquinazolin-4-yl)morpholine (PubChem CID 872410) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is 4-(2-pyridin-3-ylquinazolin-4-yl)morpholine.

Molecular Properties

Compound Name4-(2-pyridin-3-ylquinazolin-4-yl)morpholine
PubChem CID872410
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC Name4-(2-pyridin-3-ylquinazolin-4-yl)morpholine
SMILESc1cncc(-c2nc(N3CCOCC3)c3ccccc3n2)c1
InChIInChI=1S/C17H16N4O/c1-2-6-15-14(5-1)17(21-8-10-22-11-9-21)20-16(19-15)13-4-3-7-18-12-13/h1-7,12H,8-11H2
InChIKeyDHGJMRBQLPLBGN-UHFFFAOYSA-N
XLogP2.53
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-pyridin-3-ylquinazolin-4-yl)morpholine?
The IUPAC name of 4-(2-pyridin-3-ylquinazolin-4-yl)morpholine (CID 872410) is 4-(2-pyridin-3-ylquinazolin-4-yl)morpholine.
What is the SMILES notation for 4-(2-pyridin-3-ylquinazolin-4-yl)morpholine?
The canonical SMILES for 4-(2-pyridin-3-ylquinazolin-4-yl)morpholine is c1cncc(-c2nc(N3CCOCC3)c3ccccc3n2)c1.
What is the InChIKey of 4-(2-pyridin-3-ylquinazolin-4-yl)morpholine?
The InChIKey is DHGJMRBQLPLBGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c1-2-6-15-14(5-1)17(21-8-10-22-11-9-21)20-16(19-15)13-4-3-7-18-12-13/h1-7,12H,8-11H2.
What are the key properties of 4-(2-pyridin-3-ylquinazolin-4-yl)morpholine?
4-(2-pyridin-3-ylquinazolin-4-yl)morpholine has a molecular weight of 292.34 g/mol, XLogP of 2.53, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-pyridin-3-ylquinazolin-4-yl)morpholine is sourced from PubChem (CID 872410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).