2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one

C21H24N4O3 — CID 131748521

IUPAC2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one
SMILESCOc1ccc(-c2nc3ccccc3c(=O)n2NCCN2CCOCC2)cc1
InChIInChI=1S/C21H24N4O3/c1-27-17-8-6-16(7-9-17)20-23-19-5-3-2-4-18(19)21(26)25(20)22-10-11-24-12-14-28-15-13-24/h2-9,22H,10-15H2,1H3
InChIKeyWQMPBUCLLJDFHP-UHFFFAOYSA-N
MW380.45 g/mol
LogP1.95
Rot. Bonds6

About 2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one

2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one (PubChem CID 131748521) has the molecular formula C21H24N4O3 and a molecular weight of 380.45 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one
PubChem CID131748521
Molecular FormulaC21H24N4O3
Molecular Weight380.45 g/mol
Exact Mass380.18
IUPAC Name2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one
SMILESCOc1ccc(-c2nc3ccccc3c(=O)n2NCCN2CCOCC2)cc1
InChIInChI=1S/C21H24N4O3/c1-27-17-8-6-16(7-9-17)20-23-19-5-3-2-4-18(19)21(26)25(20)22-10-11-24-12-14-28-15-13-24/h2-9,22H,10-15H2,1H3
InChIKeyWQMPBUCLLJDFHP-UHFFFAOYSA-N
XLogP1.95
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.45
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide
CID 1220212
2-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)quinazolin-4-amine
CID 20963131
3-[(4-methoxyphenyl)methylamino]-2-(3-methylphenyl)quinazolin-4-one
CID 23907241
3-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)-4-oxophthalazine-1-carboxamide
CID 4053675
4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)-5-phenyl-1,3-thiazol-2-amine
CID 10250107
6-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
CID 117094011
3-[(4-bromophenyl)methylamino]-2-(3,5-dimethoxyphenyl)quinazolin-4-one
CID 24990560
6-methoxy-2-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)quinazolin-4-amine
CID 171352054
3-[2-(4-methoxyphenyl)ethyl]-2-(4-phenylphenyl)quinazolin-4-one
CID 17035993
2-(4-methoxyphenyl)-N-(2-morpholin-4-ylsulfonylethyl)quinazolin-4-amine
CID 171356984
5-(4-methoxyphenyl)-2-methyl-N-(2-morpholin-4-ylethyl)-1-phenylpyrrole-3-carboxamide
CID 42785508
4-methoxy-N-(4-oxo-2-pyridin-4-ylquinazolin-3-yl)benzamide
CID 23797785

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one?
The IUPAC name of 2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one (CID 131748521) is 2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one.
What is the SMILES notation for 2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one?
The canonical SMILES for 2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one is COc1ccc(-c2nc3ccccc3c(=O)n2NCCN2CCOCC2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one?
The InChIKey is WQMPBUCLLJDFHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O3/c1-27-17-8-6-16(7-9-17)20-23-19-5-3-2-4-18(19)21(26)25(20)22-10-11-24-12-14-28-15-13-24/h2-9,22H,10-15H2,1H3.
What are the key properties of 2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one?
2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one has a molecular weight of 380.45 g/mol, XLogP of 1.95, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one is sourced from PubChem (CID 131748521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).