2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline

C19H16N4O — CID 44603279

IUPAC2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline
SMILESCOc1ccc(-c2ncc3cc(-n4ccnc4C)ccc3n2)cc1
InChIInChI=1S/C19H16N4O/c1-13-20-9-10-23(13)16-5-8-18-15(11-16)12-21-19(22-18)14-3-6-17(24-2)7-4-14/h3-12H,1-2H3
InChIKeySTYFNFWIVSZHHG-UHFFFAOYSA-N
MW316.36 g/mol
LogP3.80
Rot. Bonds3

About 2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline

2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline (PubChem CID 44603279) has the molecular formula C19H16N4O and a molecular weight of 316.36 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline
PubChem CID44603279
Molecular FormulaC19H16N4O
Molecular Weight316.36 g/mol
Exact Mass316.13
IUPAC Name2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline
SMILESCOc1ccc(-c2ncc3cc(-n4ccnc4C)ccc3n2)cc1
InChIInChI=1S/C19H16N4O/c1-13-20-9-10-23(13)16-5-8-18-15(11-16)12-21-19(22-18)14-3-6-17(24-2)7-4-14/h3-12H,1-2H3
InChIKeySTYFNFWIVSZHHG-UHFFFAOYSA-N
XLogP3.80
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(furan-3-yl)-6-(2-methylimidazol-1-yl)quinoline;dihydrochloride
CID 67205835
2-methoxy-5-(2-methylimidazol-1-yl)benzoic acid
CID 82513098
1-[2-fluoro-4-(2-methylimidazol-1-yl)phenyl]-7-(4-methoxyphenyl)purin-6-one
CID 18753811
1-(4-methoxyphenyl)-3-methyl-6-[4-(2-methylimidazol-1-yl)phenyl]pyrazolo[4,5-d]pyrimidin-7-one
CID 22086993
4-[2-(4-methoxyphenyl)imidazol-1-yl]pyridine
CID 57150181
1-(3-methoxy-4-nitrophenyl)-2-methylimidazole
CID 11424789
CID 172687865
CID 172687865
6-methoxy-2-methylquinazoline
CID 54578216
ethene;4-(6-imidazol-1-ylquinazolin-2-yl)phenol
CID 143619140
2-methyl-5-(2-methylimidazol-1-yl)benzoic acid
CID 84681738
1-(4-butoxyphenyl)-2-methylimidazole
CID 11148936
(2R,6S,7R)-4-[4-(6-methoxyquinazolin-2-yl)phenyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione;(2R,6S,7R)-4-[4-(7-methoxyquinazolin-2-yl)phenyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione;(2R,6S,7R)-4-[4-(8-methylquinazolin-2-yl)phenyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 157066020

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline?
The IUPAC name of 2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline (CID 44603279) is 2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline.
What is the SMILES notation for 2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline?
The canonical SMILES for 2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline is COc1ccc(-c2ncc3cc(-n4ccnc4C)ccc3n2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline?
The InChIKey is STYFNFWIVSZHHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O/c1-13-20-9-10-23(13)16-5-8-18-15(11-16)12-21-19(22-18)14-3-6-17(24-2)7-4-14/h3-12H,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline?
2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline has a molecular weight of 316.36 g/mol, XLogP of 3.80, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-6-(2-methylimidazol-1-yl)quinazoline is sourced from PubChem (CID 44603279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).