2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide

C14H18N4O — CID 25160377

IUPAC2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide
SMILESCCN(CC)C(=O)c1nc(N)nc2ccc(C)cc12
InChIInChI=1S/C14H18N4O/c1-4-18(5-2)13(19)12-10-8-9(3)6-7-11(10)16-14(15)17-12/h6-8H,4-5H2,1-3H3,(H2,15,16,17)
InChIKeyMGAICQFFSSQKSR-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.00
Rot. Bonds3

About 2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide

2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide (PubChem CID 25160377) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide.

Molecular Properties

Compound Name2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide
PubChem CID25160377
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide
SMILESCCN(CC)C(=O)c1nc(N)nc2ccc(C)cc12
InChIInChI=1S/C14H18N4O/c1-4-18(5-2)13(19)12-10-8-9(3)6-7-11(10)16-14(15)17-12/h6-8H,4-5H2,1-3H3,(H2,15,16,17)
InChIKeyMGAICQFFSSQKSR-UHFFFAOYSA-N
XLogP2.00
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.00
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-diethyl-6-methylquinazoline-4-carboxamide?
The IUPAC name of 2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide (CID 25160377) is 2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide.
What is the SMILES notation for 2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide?
The canonical SMILES for 2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide is CCN(CC)C(=O)c1nc(N)nc2ccc(C)cc12.
What is the InChIKey of 2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide?
The InChIKey is MGAICQFFSSQKSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-4-18(5-2)13(19)12-10-8-9(3)6-7-11(10)16-14(15)17-12/h6-8H,4-5H2,1-3H3,(H2,15,16,17).
What are the key properties of 2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide?
2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,N-diethyl-6-methylquinazoline-4-carboxamide is sourced from PubChem (CID 25160377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).