1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one

C19H24N4O — CID 135096336

IUPAC1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one
SMILESCN(CC1CC(=O)N(C2CCCC2)C1)c1ncnc2ccccc12
InChIInChI=1S/C19H24N4O/c1-22(19-16-8-4-5-9-17(16)20-13-21-19)11-14-10-18(24)23(12-14)15-6-2-3-7-15/h4-5,8-9,13-15H,2-3,6-7,10-12H2,1H3
InChIKeyXCTUJZRXWBNPLL-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.86
Rot. Bonds4

About 1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one

1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one (PubChem CID 135096336) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one
PubChem CID135096336
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one
SMILESCN(CC1CC(=O)N(C2CCCC2)C1)c1ncnc2ccccc12
InChIInChI=1S/C19H24N4O/c1-22(19-16-8-4-5-9-17(16)20-13-21-19)11-14-10-18(24)23(12-14)15-6-2-3-7-15/h4-5,8-9,13-15H,2-3,6-7,10-12H2,1H3
InChIKeyXCTUJZRXWBNPLL-UHFFFAOYSA-N
XLogP2.86
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one?
The IUPAC name of 1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one (CID 135096336) is 1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one.
What is the SMILES notation for 1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one?
The canonical SMILES for 1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one is CN(CC1CC(=O)N(C2CCCC2)C1)c1ncnc2ccccc12.
What is the InChIKey of 1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one?
The InChIKey is XCTUJZRXWBNPLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-22(19-16-8-4-5-9-17(16)20-13-21-19)11-14-10-18(24)23(12-14)15-6-2-3-7-15/h4-5,8-9,13-15H,2-3,6-7,10-12H2,1H3.
What are the key properties of 1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one?
1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one has a molecular weight of 324.43 g/mol, XLogP of 2.86, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-[[methyl(quinazolin-4-yl)amino]methyl]pyrrolidin-2-one is sourced from PubChem (CID 135096336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).