3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline

C124H106N22O — CID 159651503

IUPAC3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline
SMILESC(=Cc1ncc2ccccc2n1)C1=NC(c2ccccc2)=CC1.C1=C(c2ccccc2)N=C(/C=C/c2ncc3ccccc3n2)C1.C1=C(c2ccccc2)N=C(CCc2ncc3ccccc3n2)C1.Cc1nc(CCc2nc3c4c(ccc3n2C)CCCO4)nc2ccccc12.Cc1nc(CCc2nc3c4cccnc4ccc3n2C)nc2ccccc12.Cn1cc(-c2ccccc2)nc1CCc1ncc2ccccc2n1
InChIInChI=1S/C22H19N5.C22H22N4O.C20H18N4.C20H17N3.2C20H15N3/c1-14-15-6-3-4-8-18(15)25-20(24-14)11-12-21-26-22-16-7-5-13-23-17(16)9-10-19(22)27(21)2;1-14-16-7-3-4-8-17(16)24-19(23-14)11-12-20-25-21-18(26(20)2)10-9-15-6-5-13-27-22(15)21;1-24-14-18(15-7-3-2-4-8-15)23-20(24)12-11-19-21-13-16-9-5-6-10-17(16)22-19;3*1-2-6-15(7-3-1)19-12-10-17(22-19)11-13-20-21-14-16-8-4-5-9-18(16)23-20/h3-10,13H,11-12H2,1-2H3;3-4,7-10H,5-6,11-13H2,1-2H3;2-10,13-14H,11-12H2,1H3;1-9,12,14H,10-11,13H2;2*1-9,11-14H,10H2/b;;;;13-11+;
InChIKeyMRPYRQHGBOFFIW-BZOGCLHFSA-N
MW1920.36 g/mol
LogP25.41
Rot. Bonds20

About 3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline

3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline (PubChem CID 159651503) has the molecular formula C124H106N22O and a molecular weight of 1920.36 g/mol. Its IUPAC name is 3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline.

Molecular Properties

Compound Name3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline
PubChem CID159651503
Molecular FormulaC124H106N22O
Molecular Weight1920.36 g/mol
Exact Mass1918.89
IUPAC Name3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline
SMILESC(=Cc1ncc2ccccc2n1)C1=NC(c2ccccc2)=CC1.C1=C(c2ccccc2)N=C(/C=C/c2ncc3ccccc3n2)C1.C1=C(c2ccccc2)N=C(CCc2ncc3ccccc3n2)C1.Cc1nc(CCc2nc3c4c(ccc3n2C)CCCO4)nc2ccccc12.Cc1nc(CCc2nc3c4cccnc4ccc3n2C)nc2ccccc12.Cn1cc(-c2ccccc2)nc1CCc1ncc2ccccc2n1
InChIInChI=1S/C22H19N5.C22H22N4O.C20H18N4.C20H17N3.2C20H15N3/c1-14-15-6-3-4-8-18(15)25-20(24-14)11-12-21-26-22-16-7-5-13-23-17(16)9-10-19(22)27(21)2;1-14-16-7-3-4-8-17(16)24-19(23-14)11-12-20-25-21-18(26(20)2)10-9-15-6-5-13-27-22(15)21;1-24-14-18(15-7-3-2-4-8-15)23-20(24)12-11-19-21-13-16-9-5-6-10-17(16)22-19;3*1-2-6-15(7-3-1)19-12-10-17(22-19)11-13-20-21-14-16-8-4-5-9-18(16)23-20/h3-10,13H,11-12H2,1-2H3;3-4,7-10H,5-6,11-13H2,1-2H3;2-10,13-14H,11-12H2,1H3;1-9,12,14H,10-11,13H2;2*1-9,11-14H,10H2/b;;;;13-11+;
InChIKeyMRPYRQHGBOFFIW-BZOGCLHFSA-N
XLogP25.41
TPSA267.34 Ų
H-Bond Donors
H-Bond Acceptors23
Rotatable Bonds20
Heavy Atoms147
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001920.36
LogP ≤ 525.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1023

Analyze 3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline?
The IUPAC name of 3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline (CID 159651503) is 3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline.
What is the SMILES notation for 3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline?
The canonical SMILES for 3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline is C(=Cc1ncc2ccccc2n1)C1=NC(c2ccccc2)=CC1.C1=C(c2ccccc2)N=C(/C=C/c2ncc3ccccc3n2)C1.C1=C(c2ccccc2)N=C(CCc2ncc3ccccc3n2)C1.Cc1nc(CCc2nc3c4c(ccc3n2C)CCCO4)nc2ccccc12.Cc1nc(CCc2nc3c4cccnc4ccc3n2C)nc2ccccc12.Cn1cc(-c2ccccc2)nc1CCc1ncc2ccccc2n1.
What is the InChIKey of 3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline?
The InChIKey is MRPYRQHGBOFFIW-BZOGCLHFSA-N. The full InChI is InChI=1S/C22H19N5.C22H22N4O.C20H18N4.C20H17N3.2C20H15N3/c1-14-15-6-3-4-8-18(15)25-20(24-14)11-12-21-26-22-16-7-5-13-23-17(16)9-10-19(22)27(21)2;1-14-16-7-3-4-8-17(16)24-19(23-14)11-12-20-25-21-18(26(20)2)10-9-15-6-5-13-27-22(15)21;1-24-14-18(15-7-3-2-4-8-15)23-20(24)12-11-19-21-13-16-9-5-6-10-17(16)22-19;3*1-2-6-15(7-3-1)19-12-10-17(22-19)11-13-20-21-14-16-8-4-5-9-18(16)23-20/h3-10,13H,11-12H2,1-2H3;3-4,7-10H,5-6,11-13H2,1-2H3;2-10,13-14H,11-12H2,1H3;1-9,12,14H,10-11,13H2;2*1-9,11-14H,10H2/b;;;;13-11+;.
What are the key properties of 3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline?
3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline has a molecular weight of 1920.36 g/mol, XLogP of 25.41, 20 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole;3-methyl-2-[2-(4-methylquinazolin-2-yl)ethyl]imidazo[4,5-f]quinoline;2-[2-(1-methyl-4-phenylimidazol-2-yl)ethyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[(E)-2-(5-phenyl-3H-pyrrol-2-yl)ethenyl]quinazoline;2-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]quinazoline is sourced from PubChem (CID 159651503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).