4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine

C21H18N4O — CID 45276194

IUPAC4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine
SMILESc1ccc(-c2nc(N3CCOCC3)nc3ccc4ncccc4c23)cc1
InChIInChI=1S/C21H18N4O/c1-2-5-15(6-3-1)20-19-16-7-4-10-22-17(16)8-9-18(19)23-21(24-20)25-11-13-26-14-12-25/h1-10H,11-14H2
InChIKeyKAMUKOJJGIDJEQ-UHFFFAOYSA-N
MW342.40 g/mol
LogP3.68
Rot. Bonds2

About 4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine

4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine (PubChem CID 45276194) has the molecular formula C21H18N4O and a molecular weight of 342.40 g/mol. Its IUPAC name is 4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine.

Molecular Properties

Compound Name4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine
PubChem CID45276194
Molecular FormulaC21H18N4O
Molecular Weight342.40 g/mol
Exact Mass342.15
IUPAC Name4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine
SMILESc1ccc(-c2nc(N3CCOCC3)nc3ccc4ncccc4c23)cc1
InChIInChI=1S/C21H18N4O/c1-2-5-15(6-3-1)20-19-16-7-4-10-22-17(16)8-9-18(19)23-21(24-20)25-11-13-26-14-12-25/h1-10H,11-14H2
InChIKeyKAMUKOJJGIDJEQ-UHFFFAOYSA-N
XLogP3.68
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

4-(2,4-dimorpholin-4-yl-6-phenylpyrimidin-5-yl)morpholine
CID 12624037
4-pyrido[3,2-d]pyrimidin-2-ylmorpholine
CID 67130702
4-[4-(4-methylpiperidin-1-yl)quinazolin-2-yl]morpholine;hydrochloride
CID 6459337
4-[2-(4-methylpiperazin-4-ium-1-yl)quinazolin-4-yl]morpholine
CID 7349051
4-(4-pyridin-2-yl-1,3,5-triazin-2-yl)morpholine
CID 141107060
8-cyclopropyl-2-morpholin-4-yl-6-phenylpteridin-7-one
CID 3234043
4-methyl-2-(4-morpholin-4-ylpyrido[3,2-d]pyrimidin-2-yl)-5-phenyl-1,2,4-triazol-3-one
CID 168922607
2-[4-(4-morpholin-4-ylquinazolin-2-yl)piperazin-1-ium-1-yl]ethanol
CID 7349238
4-(6-chloro-4-phenylquinazolin-2-yl)piperazine-1-carbaldehyde
CID 1115266
4-morpholin-4-yl-2-phenylquinazolin-6-ol
CID 3100191
6-morpholin-4-yl-2-N,4-N-bis(4-phenylphenyl)-1,3,5-triazine-2,4-diamine
CID 10074710
4-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)morpholine
CID 141367198

Frequently Asked Questions

What is the IUPAC name of 4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine?
The IUPAC name of 4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine (CID 45276194) is 4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine.
What is the SMILES notation for 4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine?
The canonical SMILES for 4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine is c1ccc(-c2nc(N3CCOCC3)nc3ccc4ncccc4c23)cc1.
What is the InChIKey of 4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine?
The InChIKey is KAMUKOJJGIDJEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O/c1-2-5-15(6-3-1)20-19-16-7-4-10-22-17(16)8-9-18(19)23-21(24-20)25-11-13-26-14-12-25/h1-10H,11-14H2.
What are the key properties of 4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine?
4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine has a molecular weight of 342.40 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-phenylpyrido[3,2-f]quinazolin-3-yl)morpholine is sourced from PubChem (CID 45276194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).