2-(ethylamino)-6-methoxy-3H-quinazolin-4-one

C11H13N3O2 — CID 137287759

IUPAC2-(ethylamino)-6-methoxy-3H-quinazolin-4-one
SMILESCCNc1nc2ccc(OC)cc2c(=O)[nH]1
InChIInChI=1S/C11H13N3O2/c1-3-12-11-13-9-5-4-7(16-2)6-8(9)10(15)14-11/h4-6H,3H2,1-2H3,(H2,12,13,14,15)
InChIKeyZCANAQKPDPJELI-UHFFFAOYSA-N
MW219.24 g/mol
LogP1.36
Rot. Bonds3

About 2-(ethylamino)-6-methoxy-3H-quinazolin-4-one

2-(ethylamino)-6-methoxy-3H-quinazolin-4-one (PubChem CID 137287759) has the molecular formula C11H13N3O2 and a molecular weight of 219.24 g/mol. Its IUPAC name is 2-(ethylamino)-6-methoxy-3H-quinazolin-4-one.

Molecular Properties

Compound Name2-(ethylamino)-6-methoxy-3H-quinazolin-4-one
PubChem CID137287759
Molecular FormulaC11H13N3O2
Molecular Weight219.24 g/mol
Exact Mass219.10
IUPAC Name2-(ethylamino)-6-methoxy-3H-quinazolin-4-one
SMILESCCNc1nc2ccc(OC)cc2c(=O)[nH]1
InChIInChI=1S/C11H13N3O2/c1-3-12-11-13-9-5-4-7(16-2)6-8(9)10(15)14-11/h4-6H,3H2,1-2H3,(H2,12,13,14,15)
InChIKeyZCANAQKPDPJELI-UHFFFAOYSA-N
XLogP1.36
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-methoxy-2-methyl-3H-quinazolin-4-one
CID 135449497
2-(ethylamino)-6,7-dimethoxy-3H-quinazolin-4-one
CID 136951517
6-methoxy-2-[(6-methoxy-4-methylquinazolin-2-yl)amino]-3H-quinazolin-4-one
CID 135448199
2-(ethylamino)-5,6,7-trimethoxy-3H-quinazolin-4-one
CID 136743156
N-[3-[(6-methoxy-4-oxo-3H-quinazolin-2-yl)amino]propyl]-2-(triazol-2-yl)benzamide
CID 145233989
(6-methoxy-4-oxo-3H-quinazolin-2-yl)methyl acetate
CID 156870481
2-[(6-methoxy-1H-benzimidazol-2-yl)amino]acetic acid
CID 82562608
N-ethyl-6-methoxy-2-phenylquinazolin-4-amine
CID 64981044
2-bromo-5-methoxy-N-[3-[(4-oxo-3H-quinazolin-2-yl)amino]propyl]benzamide
CID 137268380
2-[5-(hydroxymethyl)furan-2-yl]-6-methoxy-3H-quinazolin-4-one
CID 175773932
4-fluoro-6-methoxy-3H-quinazolin-2-one
CID 70521421
2-[(2E)-2-[(2,7-dimethoxynaphthalen-1-yl)methylidene]hydrazinyl]-3H-quinazolin-4-one
CID 135697091

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-6-methoxy-3H-quinazolin-4-one?
The IUPAC name of 2-(ethylamino)-6-methoxy-3H-quinazolin-4-one (CID 137287759) is 2-(ethylamino)-6-methoxy-3H-quinazolin-4-one.
What is the SMILES notation for 2-(ethylamino)-6-methoxy-3H-quinazolin-4-one?
The canonical SMILES for 2-(ethylamino)-6-methoxy-3H-quinazolin-4-one is CCNc1nc2ccc(OC)cc2c(=O)[nH]1.
What is the InChIKey of 2-(ethylamino)-6-methoxy-3H-quinazolin-4-one?
The InChIKey is ZCANAQKPDPJELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2/c1-3-12-11-13-9-5-4-7(16-2)6-8(9)10(15)14-11/h4-6H,3H2,1-2H3,(H2,12,13,14,15).
What are the key properties of 2-(ethylamino)-6-methoxy-3H-quinazolin-4-one?
2-(ethylamino)-6-methoxy-3H-quinazolin-4-one has a molecular weight of 219.24 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-6-methoxy-3H-quinazolin-4-one is sourced from PubChem (CID 137287759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).