N-ethyl-2,4-dimethylquinazoline-8-carboxamide

C13H15N3O — CID 159532273

IUPACN-ethyl-2,4-dimethylquinazoline-8-carboxamide
SMILESCCNC(=O)c1cccc2c(C)nc(C)nc12
InChIInChI=1S/C13H15N3O/c1-4-14-13(17)11-7-5-6-10-8(2)15-9(3)16-12(10)11/h5-7H,4H2,1-3H3,(H,14,17)
InChIKeyLXUXABLXARAQRE-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.00
Rot. Bonds2

About N-ethyl-2,4-dimethylquinazoline-8-carboxamide

N-ethyl-2,4-dimethylquinazoline-8-carboxamide (PubChem CID 159532273) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is N-ethyl-2,4-dimethylquinazoline-8-carboxamide.

Molecular Properties

Compound NameN-ethyl-2,4-dimethylquinazoline-8-carboxamide
PubChem CID159532273
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC NameN-ethyl-2,4-dimethylquinazoline-8-carboxamide
SMILESCCNC(=O)c1cccc2c(C)nc(C)nc12
InChIInChI=1S/C13H15N3O/c1-4-14-13(17)11-7-5-6-10-8(2)15-9(3)16-12(10)11/h5-7H,4H2,1-3H3,(H,14,17)
InChIKeyLXUXABLXARAQRE-UHFFFAOYSA-N
XLogP2.00
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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N-ethyl-3-methyl-2-[(4-methylquinazolin-2-yl)methoxy]benzamide
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N-ethyl-8-methylnaphthalene-1-carboxamide
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[2-(ethylcarbamoyl)phenyl]boronic acid
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8-fluoro-2-methyl-N-propylquinoline-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,4-dimethylquinazoline-8-carboxamide?
The IUPAC name of N-ethyl-2,4-dimethylquinazoline-8-carboxamide (CID 159532273) is N-ethyl-2,4-dimethylquinazoline-8-carboxamide.
What is the SMILES notation for N-ethyl-2,4-dimethylquinazoline-8-carboxamide?
The canonical SMILES for N-ethyl-2,4-dimethylquinazoline-8-carboxamide is CCNC(=O)c1cccc2c(C)nc(C)nc12.
What is the InChIKey of N-ethyl-2,4-dimethylquinazoline-8-carboxamide?
The InChIKey is LXUXABLXARAQRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-4-14-13(17)11-7-5-6-10-8(2)15-9(3)16-12(10)11/h5-7H,4H2,1-3H3,(H,14,17).
What are the key properties of N-ethyl-2,4-dimethylquinazoline-8-carboxamide?
N-ethyl-2,4-dimethylquinazoline-8-carboxamide has a molecular weight of 229.28 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,4-dimethylquinazoline-8-carboxamide is sourced from PubChem (CID 159532273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).