3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one

C16H14Cl2N4O — CID 134364837

IUPAC3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one
SMILESCCc1nc2c(Cl)ccc(Cl)c2c(=O)n1-c1cnc(N)cc1C
InChIInChI=1S/C16H14Cl2N4O/c1-3-13-21-15-10(18)5-4-9(17)14(15)16(23)22(13)11-7-20-12(19)6-8(11)2/h4-7H,3H2,1-2H3,(H2,19,20)
InChIKeyAHSRUIAZWYVXRL-UHFFFAOYSA-N
MW349.22 g/mol
LogP3.54
Rot. Bonds2

About 3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one

3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one (PubChem CID 134364837) has the molecular formula C16H14Cl2N4O and a molecular weight of 349.22 g/mol. Its IUPAC name is 3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one.

Molecular Properties

Compound Name3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one
PubChem CID134364837
Molecular FormulaC16H14Cl2N4O
Molecular Weight349.22 g/mol
Exact Mass348.05
IUPAC Name3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one
SMILESCCc1nc2c(Cl)ccc(Cl)c2c(=O)n1-c1cnc(N)cc1C
InChIInChI=1S/C16H14Cl2N4O/c1-3-13-21-15-10(18)5-4-9(17)14(15)16(23)22(13)11-7-20-12(19)6-8(11)2/h4-7H,3H2,1-2H3,(H2,19,20)
InChIKeyAHSRUIAZWYVXRL-UHFFFAOYSA-N
XLogP3.54
TPSA73.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.22
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one with MolForge

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Related Compounds

5-chloro-2-ethyl-3-(3-fluorophenyl)-8-methylquinazolin-4-one
CID 145212727
5-chloro-2-ethyl-8-fluoro-3-(5-fluoro-3-pyridinyl)quinazolin-4-one
CID 144759676
3-(5-aminopyrazin-2-yl)-9-chloro-2-ethyl-7-fluoro-5,10-dimethyl-1,3-diazecin-4-one
CID 139390889
8-chloro-3-ethyl-2,5-dimethylquinolin-4-amine
CID 107628661
3-(6-amino-3-pyridinyl)-5-chloro-2-propylquinazolin-4-one
CID 134364823
2,5-dichloro-3-ethyl-8-methylquinazolin-4-one
CID 114693017
5-chloro-2-ethyl-3-(2-methoxyphenyl)quinazolin-4-one
CID 129190696
4-ethyl-5-methylpyridin-2-amine
CID 20612507
4-amino-6-methylpyridine-3-carbonitrile;5-chloro-2-ethyl-3-phenylquinazolin-4-one
CID 144954490
(5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine
CID 63483882
5,7-dichloro-2,3-diethyl-8-hydroxyquinazolin-4-one
CID 163664717
3-(5-amino-2-bromo-3-methylphenyl)-2-ethylquinazolin-4-one
CID 166444168

Frequently Asked Questions

What is the IUPAC name of 3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one?
The IUPAC name of 3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one (CID 134364837) is 3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one.
What is the SMILES notation for 3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one?
The canonical SMILES for 3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one is CCc1nc2c(Cl)ccc(Cl)c2c(=O)n1-c1cnc(N)cc1C.
What is the InChIKey of 3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one?
The InChIKey is AHSRUIAZWYVXRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N4O/c1-3-13-21-15-10(18)5-4-9(17)14(15)16(23)22(13)11-7-20-12(19)6-8(11)2/h4-7H,3H2,1-2H3,(H2,19,20).
What are the key properties of 3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one?
3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one has a molecular weight of 349.22 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-amino-4-methyl-3-pyridinyl)-5,8-dichloro-2-ethylquinazolin-4-one is sourced from PubChem (CID 134364837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).