2-amino-N,N-dimethylquinazoline-4-carboxamide

C11H12N4O — CID 25159575

IUPAC2-amino-N,N-dimethylquinazoline-4-carboxamide
SMILESCN(C)C(=O)c1nc(N)nc2ccccc12
InChIInChI=1S/C11H12N4O/c1-15(2)10(16)9-7-5-3-4-6-8(7)13-11(12)14-9/h3-6H,1-2H3,(H2,12,13,14)
InChIKeyZILPDGBOHDRLPJ-UHFFFAOYSA-N
MW216.24 g/mol
LogP0.91
Rot. Bonds1

About 2-amino-N,N-dimethylquinazoline-4-carboxamide

2-amino-N,N-dimethylquinazoline-4-carboxamide (PubChem CID 25159575) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is 2-amino-N,N-dimethylquinazoline-4-carboxamide.

Molecular Properties

Compound Name2-amino-N,N-dimethylquinazoline-4-carboxamide
PubChem CID25159575
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC Name2-amino-N,N-dimethylquinazoline-4-carboxamide
SMILESCN(C)C(=O)c1nc(N)nc2ccccc12
InChIInChI=1S/C11H12N4O/c1-15(2)10(16)9-7-5-3-4-6-8(7)13-11(12)14-9/h3-6H,1-2H3,(H2,12,13,14)
InChIKeyZILPDGBOHDRLPJ-UHFFFAOYSA-N
XLogP0.91
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N,N-dimethylquinazoline-4-carboxamide?
The IUPAC name of 2-amino-N,N-dimethylquinazoline-4-carboxamide (CID 25159575) is 2-amino-N,N-dimethylquinazoline-4-carboxamide.
What is the SMILES notation for 2-amino-N,N-dimethylquinazoline-4-carboxamide?
The canonical SMILES for 2-amino-N,N-dimethylquinazoline-4-carboxamide is CN(C)C(=O)c1nc(N)nc2ccccc12.
What is the InChIKey of 2-amino-N,N-dimethylquinazoline-4-carboxamide?
The InChIKey is ZILPDGBOHDRLPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O/c1-15(2)10(16)9-7-5-3-4-6-8(7)13-11(12)14-9/h3-6H,1-2H3,(H2,12,13,14).
What are the key properties of 2-amino-N,N-dimethylquinazoline-4-carboxamide?
2-amino-N,N-dimethylquinazoline-4-carboxamide has a molecular weight of 216.24 g/mol, XLogP of 0.91, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,N-dimethylquinazoline-4-carboxamide is sourced from PubChem (CID 25159575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).