6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one

C15H19N3O3 — CID 175490030

IUPAC6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one
SMILESCOc1cc2c(=O)[nH]c(C)nc2cc1CC1CNCCO1
InChIInChI=1S/C15H19N3O3/c1-9-17-13-6-10(5-11-8-16-3-4-21-11)14(20-2)7-12(13)15(19)18-9/h6-7,11,16H,3-5,8H2,1-2H3,(H,17,18,19)
InChIKeyBSUHKGOZZFPHMQ-UHFFFAOYSA-N
MW289.34 g/mol
LogP0.77
Rot. Bonds3

About 6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one

6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one (PubChem CID 175490030) has the molecular formula C15H19N3O3 and a molecular weight of 289.34 g/mol. Its IUPAC name is 6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one.

Molecular Properties

Compound Name6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one
PubChem CID175490030
Molecular FormulaC15H19N3O3
Molecular Weight289.34 g/mol
Exact Mass289.14
IUPAC Name6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one
SMILESCOc1cc2c(=O)[nH]c(C)nc2cc1CC1CNCCO1
InChIInChI=1S/C15H19N3O3/c1-9-17-13-6-10(5-11-8-16-3-4-21-11)14(20-2)7-12(13)15(19)18-9/h6-7,11,16H,3-5,8H2,1-2H3,(H,17,18,19)
InChIKeyBSUHKGOZZFPHMQ-UHFFFAOYSA-N
XLogP0.77
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-3-(morpholin-2-ylmethyl)aniline;hydrochloride
CID 70130204
(2R)-2-[(2-methoxyphenyl)methyl]morpholine
CID 58689699
2-[(2,5-difluoro-4-methoxyphenyl)methyl]morpholine
CID 67073211
4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol
CID 70584076
(2R)-N-[(6,7-dimethoxy-4-oxo-3H-quinazolin-2-yl)methyl]-N-ethylmorpholine-2-carboxamide
CID 137071630
6,7-dimethoxy-2-methyl-3H-quinazolin-4-one;6-hydroxy-7-methoxy-2-methyl-3H-quinazolin-4-one;methane
CID 158479470
2,5-dimethoxy-4-methyl-N-(morpholin-2-ylmethyl)aniline
CID 115237476
6,7-dimethoxy-2-piperidin-4-yl-3H-quinazolin-4-one
CID 135853225
4-(7-methoxy-2-methyl-4-oxo-3H-quinazolin-6-yl)piperidine-1-carboxylic acid
CID 175809486
2-[[4-methyl-6-(1H-pyrrol-2-yl)pyrimidin-2-yl]methyl]morpholine
CID 116895639
7-methoxy-2-methyl-6-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-3H-quinazolin-4-one
CID 167028862
2-(cyclopropylmethyl)-6,7-dimethoxy-3H-quinazolin-4-one
CID 136640407

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one?
The IUPAC name of 6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one (CID 175490030) is 6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one.
What is the SMILES notation for 6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one?
The canonical SMILES for 6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one is COc1cc2c(=O)[nH]c(C)nc2cc1CC1CNCCO1.
What is the InChIKey of 6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one?
The InChIKey is BSUHKGOZZFPHMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-9-17-13-6-10(5-11-8-16-3-4-21-11)14(20-2)7-12(13)15(19)18-9/h6-7,11,16H,3-5,8H2,1-2H3,(H,17,18,19).
What are the key properties of 6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one?
6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one has a molecular weight of 289.34 g/mol, XLogP of 0.77, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-methyl-7-(morpholin-2-ylmethyl)-3H-quinazolin-4-one is sourced from PubChem (CID 175490030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).