N-(4-oxoquinazolin-3-yl)pentanamide

C13H15N3O2 — CID 27757903

IUPACN-(4-oxoquinazolin-3-yl)pentanamide
SMILESCCCCC(=O)Nn1cnc2ccccc2c1=O
InChIInChI=1S/C13H15N3O2/c1-2-3-8-12(17)15-16-9-14-11-7-5-4-6-10(11)13(16)18/h4-7,9H,2-3,8H2,1H3,(H,15,17)
InChIKeyGWFVGWPPWVAGLJ-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.66
Rot. Bonds4

About N-(4-oxoquinazolin-3-yl)pentanamide

N-(4-oxoquinazolin-3-yl)pentanamide (PubChem CID 27757903) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is N-(4-oxoquinazolin-3-yl)pentanamide.

Molecular Properties

Compound NameN-(4-oxoquinazolin-3-yl)pentanamide
PubChem CID27757903
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC NameN-(4-oxoquinazolin-3-yl)pentanamide
SMILESCCCCC(=O)Nn1cnc2ccccc2c1=O
InChIInChI=1S/C13H15N3O2/c1-2-3-8-12(17)15-16-9-14-11-7-5-4-6-10(11)13(16)18/h4-7,9H,2-3,8H2,1H3,(H,15,17)
InChIKeyGWFVGWPPWVAGLJ-UHFFFAOYSA-N
XLogP1.66
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-oxo-3-propylbenzimidazol-1-yl)-N-(4-oxoquinazolin-3-yl)propanamide
CID 134061353
3-(4-oxo-1,2,3-benzotriazin-3-yl)-N-(4-oxoquinazolin-3-yl)propanamide
CID 134061354
N-(4-oxoquinazolin-3-yl)-2-(4-phenylphenyl)acetamide
CID 26181771
N-nonyl-4-(4-oxoquinazolin-3-yl)butanamide
CID 43052254
N-butyl-2-(4-oxoquinazolin-3-yl)acetamide
CID 2286297
1-N,2-N-bis(4-oxoquinazolin-3-yl)cyclopropane-1,2-dicarboxamide
CID 166206906
N-(2-methyl-4-oxoquinazolin-3-yl)hexanamide
CID 5090042
4-ethyl-N-(4-oxoquinazolin-3-yl)thiadiazole-5-carboxamide
CID 75413353
4-fluoro-N-(4-oxoquinazolin-3-yl)benzamide
CID 3691109
N-[(2R)-octan-2-yl]-2-(4-oxoquinazolin-3-yl)acetamide
CID 9287384
2-[(5R)-3-benzyl-2,4-dioxo-1,3-thiazolidin-5-yl]-N-(4-oxoquinazolin-3-yl)acetamide
CID 27271990
3-[2-(butylamino)ethyl]quinazolin-4-one
CID 62562678

Frequently Asked Questions

What is the IUPAC name of N-(4-oxoquinazolin-3-yl)pentanamide?
The IUPAC name of N-(4-oxoquinazolin-3-yl)pentanamide (CID 27757903) is N-(4-oxoquinazolin-3-yl)pentanamide.
What is the SMILES notation for N-(4-oxoquinazolin-3-yl)pentanamide?
The canonical SMILES for N-(4-oxoquinazolin-3-yl)pentanamide is CCCCC(=O)Nn1cnc2ccccc2c1=O.
What is the InChIKey of N-(4-oxoquinazolin-3-yl)pentanamide?
The InChIKey is GWFVGWPPWVAGLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-2-3-8-12(17)15-16-9-14-11-7-5-4-6-10(11)13(16)18/h4-7,9H,2-3,8H2,1H3,(H,15,17).
What are the key properties of N-(4-oxoquinazolin-3-yl)pentanamide?
N-(4-oxoquinazolin-3-yl)pentanamide has a molecular weight of 245.28 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxoquinazolin-3-yl)pentanamide is sourced from PubChem (CID 27757903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).