[4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone

C19H24N4O4 — CID 15818184

IUPAC[4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone
SMILESCOc1cc2cnc(N3CCN(C(=O)C4CCCO4)CC3)nc2cc1OC
InChIInChI=1S/C19H24N4O4/c1-25-16-10-13-12-20-19(21-14(13)11-17(16)26-2)23-7-5-22(6-8-23)18(24)15-4-3-9-27-15/h10-12,15H,3-9H2,1-2H3
InChIKeyIMASTEREZFYIBH-UHFFFAOYSA-N
MW372.43 g/mol
LogP1.47
Rot. Bonds4

About [4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone

[4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone (PubChem CID 15818184) has the molecular formula C19H24N4O4 and a molecular weight of 372.43 g/mol. Its IUPAC name is [4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone.

Molecular Properties

Compound Name[4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone
PubChem CID15818184
Molecular FormulaC19H24N4O4
Molecular Weight372.43 g/mol
Exact Mass372.18
IUPAC Name[4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone
SMILESCOc1cc2cnc(N3CCN(C(=O)C4CCCO4)CC3)nc2cc1OC
InChIInChI=1S/C19H24N4O4/c1-25-16-10-13-12-20-19(21-14(13)11-17(16)26-2)23-7-5-22(6-8-23)18(24)15-4-3-9-27-15/h10-12,15H,3-9H2,1-2H3
InChIKeyIMASTEREZFYIBH-UHFFFAOYSA-N
XLogP1.47
TPSA77.02 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone;hydrobromide;hydrochloride
CID 140517129
[4-(4-amino-7-fluoro-6-methoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 66546959
[4-(5,6-dimethoxy-1H-benzimidazol-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone;hydrochloride
CID 70619263
[4-(4-amino-6,7-dimethoxyquinazolin-3-ium-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone chloride
CID 135958608
[4-(5-amino-2-methoxyphenyl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 82533904
[(2S)-oxolan-2-yl]-[4-(4-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]methanone
CID 126783230
1-(3,4-dimethoxyphenyl)-2-[4-(oxolane-2-carbonyl)piperazin-1-yl]ethanone
CID 110368785
[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-[(5S)-5-methyloxolan-2-yl]methanone
CID 72941989
[(2S)-oxolan-2-yl]-[4-(2-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone
CID 95875384
[4-(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 121031849
[3-(3,4-dimethoxyphenyl)-4-methylpiperazin-1-yl]-(oxolan-2-yl)methanone
CID 110293371
oxolan-2-yl-(4-quinazolin-6-ylpiperazin-1-yl)methanone
CID 126894159

Frequently Asked Questions

What is the IUPAC name of [4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone?
The IUPAC name of [4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone (CID 15818184) is [4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone.
What is the SMILES notation for [4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone?
The canonical SMILES for [4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone is COc1cc2cnc(N3CCN(C(=O)C4CCCO4)CC3)nc2cc1OC.
What is the InChIKey of [4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone?
The InChIKey is IMASTEREZFYIBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O4/c1-25-16-10-13-12-20-19(21-14(13)11-17(16)26-2)23-7-5-22(6-8-23)18(24)15-4-3-9-27-15/h10-12,15H,3-9H2,1-2H3.
What are the key properties of [4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone?
[4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone has a molecular weight of 372.43 g/mol, XLogP of 1.47, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone is sourced from PubChem (CID 15818184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).