3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide

C19H24N4O3 — CID 51272641

IUPAC3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide
SMILESCc1cccc2c(=O)n(CCC(=O)NCCC(=O)N3CCCC3)cnc12
InChIInChI=1S/C19H24N4O3/c1-14-5-4-6-15-18(14)21-13-23(19(15)26)12-8-16(24)20-9-7-17(25)22-10-2-3-11-22/h4-6,13H,2-3,7-12H2,1H3,(H,20,24)
InChIKeyKCPHTWWZZQSZGY-UHFFFAOYSA-N
MW356.43 g/mol
LogP1.22
Rot. Bonds6

About 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide

3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide (PubChem CID 51272641) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide.

Molecular Properties

Compound Name3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide
PubChem CID51272641
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC Name3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide
SMILESCc1cccc2c(=O)n(CCC(=O)NCCC(=O)N3CCCC3)cnc12
InChIInChI=1S/C19H24N4O3/c1-14-5-4-6-15-18(14)21-13-23(19(15)26)12-8-16(24)20-9-7-17(25)22-10-2-3-11-22/h4-6,13H,2-3,7-12H2,1H3,(H,20,24)
InChIKeyKCPHTWWZZQSZGY-UHFFFAOYSA-N
XLogP1.22
TPSA84.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide?
The IUPAC name of 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide (CID 51272641) is 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide.
What is the SMILES notation for 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide?
The canonical SMILES for 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide is Cc1cccc2c(=O)n(CCC(=O)NCCC(=O)N3CCCC3)cnc12.
What is the InChIKey of 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide?
The InChIKey is KCPHTWWZZQSZGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-14-5-4-6-15-18(14)21-13-23(19(15)26)12-8-16(24)20-9-7-17(25)22-10-2-3-11-22/h4-6,13H,2-3,7-12H2,1H3,(H,20,24).
What are the key properties of 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide?
3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide has a molecular weight of 356.43 g/mol, XLogP of 1.22, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide is sourced from PubChem (CID 51272641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).