2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one

C23H21N5O2 — CID 123765235

IUPAC2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one
SMILESNc1nc2ccc(-c3ccc(N4CCOCC4)nc3)cc2c(=O)n1-c1ccccc1
InChIInChI=1S/C23H21N5O2/c24-23-26-20-8-6-16(14-19(20)22(29)28(23)18-4-2-1-3-5-18)17-7-9-21(25-15-17)27-10-12-30-13-11-27/h1-9,14-15H,10-13H2,(H2,24,26)
InChIKeyAVIDVEMMDKPJIU-UHFFFAOYSA-N
MW399.45 g/mol
LogP2.87
Rot. Bonds3

About 2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one

2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one (PubChem CID 123765235) has the molecular formula C23H21N5O2 and a molecular weight of 399.45 g/mol. Its IUPAC name is 2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one.

Molecular Properties

Compound Name2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one
PubChem CID123765235
Molecular FormulaC23H21N5O2
Molecular Weight399.45 g/mol
Exact Mass399.17
IUPAC Name2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one
SMILESNc1nc2ccc(-c3ccc(N4CCOCC4)nc3)cc2c(=O)n1-c1ccccc1
InChIInChI=1S/C23H21N5O2/c24-23-26-20-8-6-16(14-19(20)22(29)28(23)18-4-2-1-3-5-18)17-7-9-21(25-15-17)27-10-12-30-13-11-27/h1-9,14-15H,10-13H2,(H2,24,26)
InChIKeyAVIDVEMMDKPJIU-UHFFFAOYSA-N
XLogP2.87
TPSA86.27 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-[2-amino-3-(4-morpholin-4-ylphenyl)-4-oxoquinazolin-6-yl]-N-(2-fluorophenyl)-2-methoxypyridine-3-sulfonamide
CID 67985545
2-amino-6-(5,6-dimethoxy-3-pyridinyl)-3-phenylquinazolin-4-one
CID 67982499
2-amino-6-[5-(2,4-dimethyl-1,2,4-oxadiazolidin-3-yl)-6-methoxy-3-pyridinyl]-3-phenylquinazolin-4-one
CID 123312166
5-(2-amino-4-oxo-3-phenylquinazolin-6-yl)-N-benzyl-2-chloropyridine-3-sulfonamide
CID 88540453
4-[5-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-2-pyridinyl]morpholine
CID 58507795
3-(1,3-dihydroisoindol-2-yl)-5-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine
CID 90435597
4-(5-pyridin-4-yl-2-pyridinyl)morpholine
CID 10377044
5-(6-morpholin-4-yl-3-pyridinyl)-N-phenylpyridine-3-carboxamide
CID 117089330
N-[5-[2-amino-3-[3-(morpholine-4-carbonyl)phenyl]-4-oxoquinazolin-6-yl]-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide
CID 57406167
N-[5-(2-amino-4-oxo-3-phenylquinazolin-6-yl)-2-methoxy-3-pyridinyl]thiophene-2-sulfonamide
CID 57405317
6-methyl-2-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-amine
CID 117085161
5-(2-amino-4-oxo-3-phenylquinazolin-6-yl)-N-benzyl-2-methoxy-N-methylpyridine-3-sulfonamide;formic acid
CID 67981438

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one?
The IUPAC name of 2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one (CID 123765235) is 2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one.
What is the SMILES notation for 2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one?
The canonical SMILES for 2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one is Nc1nc2ccc(-c3ccc(N4CCOCC4)nc3)cc2c(=O)n1-c1ccccc1.
What is the InChIKey of 2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one?
The InChIKey is AVIDVEMMDKPJIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O2/c24-23-26-20-8-6-16(14-19(20)22(29)28(23)18-4-2-1-3-5-18)17-7-9-21(25-15-17)27-10-12-30-13-11-27/h1-9,14-15H,10-13H2,(H2,24,26).
What are the key properties of 2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one?
2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one has a molecular weight of 399.45 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(6-morpholin-4-yl-3-pyridinyl)-3-phenylquinazolin-4-one is sourced from PubChem (CID 123765235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).