2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone

C92H81ClN30O2 — CID 158900260

IUPAC2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone
SMILESCC(=O)c1ccccc1-c1nc(Nc2n[nH]c(C)n2)c2ccccc2n1.COc1ccccc1-c1nc(Nc2n[nH]c(C)n2)c2ccccc2n1.Cc1nc(Nc2nc(-c3c(C)cccc3C)nc3ccccc23)n[nH]1.Cc1nc(Nc2nc(-c3cccc(C)c3C)nc3ccccc23)n[nH]1.Cc1nc(Nc2nc(-c3ccccc3Cl)nc3ccccc23)n[nH]1
InChIInChI=1S/C19H16N6O.2C19H18N6.C18H16N6O.C17H13ClN6/c1-11(26)13-7-3-4-8-14(13)17-21-16-10-6-5-9-15(16)18(22-17)23-19-20-12(2)24-25-19;1-11-7-6-8-12(2)16(11)18-21-15-10-5-4-9-14(15)17(22-18)23-19-20-13(3)24-25-19;1-11-7-6-9-14(12(11)2)17-21-16-10-5-4-8-15(16)18(22-17)23-19-20-13(3)24-25-19;1-11-19-18(24-23-11)22-16-12-7-3-5-9-14(12)20-17(21-16)13-8-4-6-10-15(13)25-2;1-10-19-17(24-23-10)22-16-12-7-3-5-9-14(12)20-15(21-16)11-6-2-4-8-13(11)18/h3-10H,1-2H3,(H2,20,21,22,23,24,25);2*4-10H,1-3H3,(H2,20,21,22,23,24,25);3-10H,1-2H3,(H2,19,20,21,22,23,24);2-9H,1H3,(H2,19,20,21,22,23,24)
InChIKeyJFIQYXLYMSGDAW-UHFFFAOYSA-N
MW1674.32 g/mol
LogP19.43
Rot. Bonds17

About 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone

2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone (PubChem CID 158900260) has the molecular formula C92H81ClN30O2 and a molecular weight of 1674.32 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone
PubChem CID158900260
Molecular FormulaC92H81ClN30O2
Molecular Weight1674.32 g/mol
Exact Mass1672.68
IUPAC Name2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone
SMILESCC(=O)c1ccccc1-c1nc(Nc2n[nH]c(C)n2)c2ccccc2n1.COc1ccccc1-c1nc(Nc2n[nH]c(C)n2)c2ccccc2n1.Cc1nc(Nc2nc(-c3c(C)cccc3C)nc3ccccc23)n[nH]1.Cc1nc(Nc2nc(-c3cccc(C)c3C)nc3ccccc23)n[nH]1.Cc1nc(Nc2nc(-c3ccccc3Cl)nc3ccccc23)n[nH]1
InChIInChI=1S/C19H16N6O.2C19H18N6.C18H16N6O.C17H13ClN6/c1-11(26)13-7-3-4-8-14(13)17-21-16-10-6-5-9-15(16)18(22-17)23-19-20-12(2)24-25-19;1-11-7-6-8-12(2)16(11)18-21-15-10-5-4-9-14(15)17(22-18)23-19-20-13(3)24-25-19;1-11-7-6-9-14(12(11)2)17-21-16-10-5-4-8-15(16)18(22-17)23-19-20-13(3)24-25-19;1-11-19-18(24-23-11)22-16-12-7-3-5-9-14(12)20-17(21-16)13-8-4-6-10-15(13)25-2;1-10-19-17(24-23-10)22-16-12-7-3-5-9-14(12)20-15(21-16)11-6-2-4-8-13(11)18/h3-10H,1-2H3,(H2,20,21,22,23,24,25);2*4-10H,1-3H3,(H2,20,21,22,23,24,25);3-10H,1-2H3,(H2,19,20,21,22,23,24);2-9H,1H3,(H2,19,20,21,22,23,24)
InChIKeyJFIQYXLYMSGDAW-UHFFFAOYSA-N
XLogP19.43
TPSA423.20 Ų
H-Bond Donors10
H-Bond Acceptors27
Rotatable Bonds17
Heavy Atoms125
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001674.32
LogP ≤ 519.43
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1027

Analyze 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone with MolForge

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Launch Full Analysis

Related Compounds

2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;8-ethyl-N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethoxy)phenyl]quinazolin-4-amine;5-fluoro-N-[2-[2-(trifluoromethyl)phenyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]-1H-indazol-3-amine;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-8-methyl-2-[2-(trifluoromethoxy)phenyl]quinazolin-4-amine
CID 160956276
2-(4-chlorophenyl)-7-methoxy-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;N-methyl-2-(3-methylphenyl)-4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazoline-7-carboxamide;7-methyl-N-(5-methyl-1H-pyrazol-3-yl)-2-phenylquinazolin-4-amine;2-(1-methylpiperidin-4-yl)-N-(5-methyl-1H-pyrazol-3-yl)-7-propan-2-ylquinazolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-pyridin-3-ylquinazolin-4-amine
CID 158498475
2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-(2,4-difluorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-(2,4-dimethoxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-(2-methylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine
CID 160114604
2-(2-tert-butylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-cyclopropylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;bis(2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine);2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenol
CID 161196781

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone?
The IUPAC name of 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone (CID 158900260) is 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone.
What is the SMILES notation for 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone?
The canonical SMILES for 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone is CC(=O)c1ccccc1-c1nc(Nc2n[nH]c(C)n2)c2ccccc2n1.COc1ccccc1-c1nc(Nc2n[nH]c(C)n2)c2ccccc2n1.Cc1nc(Nc2nc(-c3c(C)cccc3C)nc3ccccc23)n[nH]1.Cc1nc(Nc2nc(-c3cccc(C)c3C)nc3ccccc23)n[nH]1.Cc1nc(Nc2nc(-c3ccccc3Cl)nc3ccccc23)n[nH]1.
What is the InChIKey of 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone?
The InChIKey is JFIQYXLYMSGDAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N6O.2C19H18N6.C18H16N6O.C17H13ClN6/c1-11(26)13-7-3-4-8-14(13)17-21-16-10-6-5-9-15(16)18(22-17)23-19-20-12(2)24-25-19;1-11-7-6-8-12(2)16(11)18-21-15-10-5-4-9-14(15)17(22-18)23-19-20-13(3)24-25-19;1-11-7-6-9-14(12(11)2)17-21-16-10-5-4-8-15(16)18(22-17)23-19-20-13(3)24-25-19;1-11-19-18(24-23-11)22-16-12-7-3-5-9-14(12)20-17(21-16)13-8-4-6-10-15(13)25-2;1-10-19-17(24-23-10)22-16-12-7-3-5-9-14(12)20-15(21-16)11-6-2-4-8-13(11)18/h3-10H,1-2H3,(H2,20,21,22,23,24,25);2*4-10H,1-3H3,(H2,20,21,22,23,24,25);3-10H,1-2H3,(H2,19,20,21,22,23,24);2-9H,1H3,(H2,19,20,21,22,23,24).
What are the key properties of 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone?
2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone has a molecular weight of 1674.32 g/mol, XLogP of 19.43, 17 rotatable bonds, 10 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,3-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2,6-dimethylphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;2-(2-methoxyphenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)quinazolin-4-amine;1-[2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone is sourced from PubChem (CID 158900260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).