6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one

C106H90N14O6 — CID 159977746

IUPAC6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one
SMILESCN(C)c1ccc2nc(-c3cccc4ccccc34)[nH]c(=O)c2c1.Cc1ccc2nc(-c3cccc4ccccc34)[nH]c(=O)c2c1.O=c1[nH]c(-c2cccc3ccccc23)nc2ccc(N3CCCC3)cc12.O=c1[nH]c(-c2cccc3ccccc23)nc2ccc(N3CCCCC3)cc12.O=c1[nH]c(-c2cccc3ccccc23)nc2ccc(N3CCOCC3)cc12
InChIInChI=1S/C23H21N3O.C22H19N3O2.C22H19N3O.C20H17N3O.C19H14N2O/c27-23-20-15-17(26-13-4-1-5-14-26)11-12-21(20)24-22(25-23)19-10-6-8-16-7-2-3-9-18(16)19;26-22-19-14-16(25-10-12-27-13-11-25)8-9-20(19)23-21(24-22)18-7-3-5-15-4-1-2-6-17(15)18;26-22-19-14-16(25-12-3-4-13-25)10-11-20(19)23-21(24-22)18-9-5-7-15-6-1-2-8-17(15)18;1-23(2)14-10-11-18-17(12-14)20(24)22-19(21-18)16-9-5-7-13-6-3-4-8-15(13)16;1-12-9-10-17-16(11-12)19(22)21-18(20-17)15-8-4-6-13-5-2-3-7-14(13)15/h2-3,6-12,15H,1,4-5,13-14H2,(H,24,25,27);1-9,14H,10-13H2,(H,23,24,26);1-2,5-11,14H,3-4,12-13H2,(H,23,24,26);3-12H,1-2H3,(H,21,22,24);2-11H,1H3,(H,20,21,22)
InChIKeyOFJHEDQBHVROHO-UHFFFAOYSA-N
MW1655.98 g/mol
LogP20.52
Rot. Bonds9

About 6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one

6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one (PubChem CID 159977746) has the molecular formula C106H90N14O6 and a molecular weight of 1655.98 g/mol. Its IUPAC name is 6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one.

Molecular Properties

Compound Name6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one
PubChem CID159977746
Molecular FormulaC106H90N14O6
Molecular Weight1655.98 g/mol
Exact Mass1654.72
IUPAC Name6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one
SMILESCN(C)c1ccc2nc(-c3cccc4ccccc34)[nH]c(=O)c2c1.Cc1ccc2nc(-c3cccc4ccccc34)[nH]c(=O)c2c1.O=c1[nH]c(-c2cccc3ccccc23)nc2ccc(N3CCCC3)cc12.O=c1[nH]c(-c2cccc3ccccc23)nc2ccc(N3CCCCC3)cc12.O=c1[nH]c(-c2cccc3ccccc23)nc2ccc(N3CCOCC3)cc12
InChIInChI=1S/C23H21N3O.C22H19N3O2.C22H19N3O.C20H17N3O.C19H14N2O/c27-23-20-15-17(26-13-4-1-5-14-26)11-12-21(20)24-22(25-23)19-10-6-8-16-7-2-3-9-18(16)19;26-22-19-14-16(25-10-12-27-13-11-25)8-9-20(19)23-21(24-22)18-7-3-5-15-4-1-2-6-17(15)18;26-22-19-14-16(25-12-3-4-13-25)10-11-20(19)23-21(24-22)18-9-5-7-15-6-1-2-8-17(15)18;1-23(2)14-10-11-18-17(12-14)20(24)22-19(21-18)16-9-5-7-13-6-3-4-8-15(13)16;1-12-9-10-17-16(11-12)19(22)21-18(20-17)15-8-4-6-13-5-2-3-7-14(13)15/h2-3,6-12,15H,1,4-5,13-14H2,(H,24,25,27);1-9,14H,10-13H2,(H,23,24,26);1-2,5-11,14H,3-4,12-13H2,(H,23,24,26);3-12H,1-2H3,(H,21,22,24);2-11H,1H3,(H,20,21,22)
InChIKeyOFJHEDQBHVROHO-UHFFFAOYSA-N
XLogP20.52
TPSA250.94 Ų
H-Bond Donors5
H-Bond Acceptors15
Rotatable Bonds9
Heavy Atoms126
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001655.98
LogP ≤ 520.52
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1015

Analyze 6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one with MolForge

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Related Compounds

2-(1-benzothiophen-3-yl)-6-morpholin-4-yl-3H-quinazolin-4-one;2-(1-benzothiophen-3-yl)-6-piperidin-1-yl-3H-quinazolin-4-one;2-(1-benzothiophen-3-yl)-6-pyrrolidin-1-yl-3H-quinazolin-4-one
CID 158662772
7-(dimethylamino)-3-(3-morpholin-4-ylphenyl)-2H-isoquinolin-1-one
CID 143087038
2-tert-butyl-6-morpholin-4-yl-3H-quinazolin-4-one
CID 140904912
2-naphthalen-1-yl-3H-quinazolin-4-one
CID 135437423
6-(dimethylamino)-2-(2-hydroxyphenyl)-1H-quinolin-4-one;6-(dimethylamino)-2-(3-methylphenyl)-1H-quinolin-4-one;2-(2-hydroxyphenyl)-6-pyrrolidin-1-yl-1H-quinolin-4-one;2-(3-methylphenyl)-6-pyrrolidin-1-yl-1H-quinolin-4-one
CID 161360591
N-[2-(6-methyl-4-oxo-3H-quinazolin-2-yl)phenyl]methanesulfonamide
CID 142133755
4-oxo-6-piperidin-1-yl-3H-quinazoline-2-carbonitrile
CID 142062413
2-(4-bromo-2-piperidin-1-ylphenyl)-3H-quinazolin-4-one
CID 168553125
2-cyclohexyl-6-pyrrolidin-1-yl-3H-quinazolin-4-one
CID 135447986
N-methyl-N'-[4-methyl-2-(6-morpholin-4-yl-1H-benzimidazol-2-yl)phenyl]ethane-1,2-diamine
CID 141053448
2-[4-fluoro-2-(morpholin-4-ylmethyl)phenyl]-3H-quinazolin-4-one
CID 168551316
N,N-dimethyl-4-morpholin-4-ylaniline
CID 11264229

Frequently Asked Questions

What is the IUPAC name of 6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one?
The IUPAC name of 6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one (CID 159977746) is 6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one.
What is the SMILES notation for 6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one?
The canonical SMILES for 6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one is CN(C)c1ccc2nc(-c3cccc4ccccc34)[nH]c(=O)c2c1.Cc1ccc2nc(-c3cccc4ccccc34)[nH]c(=O)c2c1.O=c1[nH]c(-c2cccc3ccccc23)nc2ccc(N3CCCC3)cc12.O=c1[nH]c(-c2cccc3ccccc23)nc2ccc(N3CCCCC3)cc12.O=c1[nH]c(-c2cccc3ccccc23)nc2ccc(N3CCOCC3)cc12.
What is the InChIKey of 6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one?
The InChIKey is OFJHEDQBHVROHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O.C22H19N3O2.C22H19N3O.C20H17N3O.C19H14N2O/c27-23-20-15-17(26-13-4-1-5-14-26)11-12-21(20)24-22(25-23)19-10-6-8-16-7-2-3-9-18(16)19;26-22-19-14-16(25-10-12-27-13-11-25)8-9-20(19)23-21(24-22)18-7-3-5-15-4-1-2-6-17(15)18;26-22-19-14-16(25-12-3-4-13-25)10-11-20(19)23-21(24-22)18-9-5-7-15-6-1-2-8-17(15)18;1-23(2)14-10-11-18-17(12-14)20(24)22-19(21-18)16-9-5-7-13-6-3-4-8-15(13)16;1-12-9-10-17-16(11-12)19(22)21-18(20-17)15-8-4-6-13-5-2-3-7-14(13)15/h2-3,6-12,15H,1,4-5,13-14H2,(H,24,25,27);1-9,14H,10-13H2,(H,23,24,26);1-2,5-11,14H,3-4,12-13H2,(H,23,24,26);3-12H,1-2H3,(H,21,22,24);2-11H,1H3,(H,20,21,22).
What are the key properties of 6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one?
6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one has a molecular weight of 1655.98 g/mol, XLogP of 20.52, 9 rotatable bonds, 5 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylamino)-2-naphthalen-1-yl-3H-quinazolin-4-one;6-methyl-2-naphthalen-1-yl-3H-quinazolin-4-one;6-morpholin-4-yl-2-naphthalen-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-piperidin-1-yl-3H-quinazolin-4-one;2-naphthalen-1-yl-6-pyrrolidin-1-yl-3H-quinazolin-4-one is sourced from PubChem (CID 159977746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).