2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide

C20H28N4O2 — CID 17394856

IUPAC2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide
SMILESCc1cccc2c(=O)n(CC(=O)NCC(C)(C)N3CCCCC3)cnc12
InChIInChI=1S/C20H28N4O2/c1-15-8-7-9-16-18(15)22-14-23(19(16)26)12-17(25)21-13-20(2,3)24-10-5-4-6-11-24/h7-9,14H,4-6,10-13H2,1-3H3,(H,21,25)
InChIKeyHZNMIOWDVBWHIS-UHFFFAOYSA-N
MW356.47 g/mol
LogP2.09
Rot. Bonds5

About 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide

2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide (PubChem CID 17394856) has the molecular formula C20H28N4O2 and a molecular weight of 356.47 g/mol. Its IUPAC name is 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide.

Molecular Properties

Compound Name2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide
PubChem CID17394856
Molecular FormulaC20H28N4O2
Molecular Weight356.47 g/mol
Exact Mass356.22
IUPAC Name2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide
SMILESCc1cccc2c(=O)n(CC(=O)NCC(C)(C)N3CCCCC3)cnc12
InChIInChI=1S/C20H28N4O2/c1-15-8-7-9-16-18(15)22-14-23(19(16)26)12-17(25)21-13-20(2,3)24-10-5-4-6-11-24/h7-9,14H,4-6,10-13H2,1-3H3,(H,21,25)
InChIKeyHZNMIOWDVBWHIS-UHFFFAOYSA-N
XLogP2.09
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide?
The IUPAC name of 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide (CID 17394856) is 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide.
What is the SMILES notation for 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide?
The canonical SMILES for 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide is Cc1cccc2c(=O)n(CC(=O)NCC(C)(C)N3CCCCC3)cnc12.
What is the InChIKey of 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide?
The InChIKey is HZNMIOWDVBWHIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O2/c1-15-8-7-9-16-18(15)22-14-23(19(16)26)12-17(25)21-13-20(2,3)24-10-5-4-6-11-24/h7-9,14H,4-6,10-13H2,1-3H3,(H,21,25).
What are the key properties of 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide?
2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide has a molecular weight of 356.47 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)acetamide is sourced from PubChem (CID 17394856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).