2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine

C101H90ClFN28O9 — CID 157110281

IUPAC2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine
SMILESCOCCNc1nc(Nc2ccc3[nH]ncc3c2)c2cc(OC)c(OC)cc2n1.COc1cc2nc(Cl)nc(Nc3ccc4[nH]ncc4c3)c2cc1OC.COc1cc2nc(NC3CC3)nc(Nc3ccc4[nH]ncc4c3)c2cc1OC.COc1cc2nc(Nc3ccc(F)cc3)nc(Nc3ccc4[nH]ncc4c3)c2cc1OC.c1ccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3ccccc3n2)cc1
InChIInChI=1S/C23H19FN6O2.C21H15N5.C20H22N6O3.C20H20N6O2.C17H14ClN5O2/c1-31-20-10-17-19(11-21(20)32-2)28-23(27-15-5-3-14(24)4-6-15)29-22(17)26-16-7-8-18-13(9-16)12-25-30-18;1-2-6-14(7-3-1)20-24-19-9-5-4-8-17(19)21(25-20)23-16-10-11-18-15(12-16)13-22-26-18;1-27-7-6-21-20-24-16-10-18(29-3)17(28-2)9-14(16)19(25-20)23-13-4-5-15-12(8-13)11-22-26-15;1-27-17-8-14-16(9-18(17)28-2)24-20(23-12-3-4-12)25-19(14)22-13-5-6-15-11(7-13)10-21-26-15;1-24-14-6-11-13(7-15(14)25-2)21-17(18)22-16(11)20-10-3-4-12-9(5-10)8-19-23-12/h3-12H,1-2H3,(H,25,30)(H2,26,27,28,29);1-13H,(H,22,26)(H,23,24,25);4-5,8-11H,6-7H2,1-3H3,(H,22,26)(H2,21,23,24,25);5-10,12H,3-4H2,1-2H3,(H,21,26)(H2,22,23,24,25);3-8H,1-2H3,(H,19,23)(H,20,21,22)
InChIKeyAGTPNYWKFGYONL-UHFFFAOYSA-N
MW1894.47 g/mol
LogP21.15
Rot. Bonds27

About 2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine

2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine (PubChem CID 157110281) has the molecular formula C101H90ClFN28O9 and a molecular weight of 1894.47 g/mol. Its IUPAC name is 2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine.

Molecular Properties

Compound Name2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine
PubChem CID157110281
Molecular FormulaC101H90ClFN28O9
Molecular Weight1894.47 g/mol
Exact Mass1892.71
IUPAC Name2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine
SMILESCOCCNc1nc(Nc2ccc3[nH]ncc3c2)c2cc(OC)c(OC)cc2n1.COc1cc2nc(Cl)nc(Nc3ccc4[nH]ncc4c3)c2cc1OC.COc1cc2nc(NC3CC3)nc(Nc3ccc4[nH]ncc4c3)c2cc1OC.COc1cc2nc(Nc3ccc(F)cc3)nc(Nc3ccc4[nH]ncc4c3)c2cc1OC.c1ccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3ccccc3n2)cc1
InChIInChI=1S/C23H19FN6O2.C21H15N5.C20H22N6O3.C20H20N6O2.C17H14ClN5O2/c1-31-20-10-17-19(11-21(20)32-2)28-23(27-15-5-3-14(24)4-6-15)29-22(17)26-16-7-8-18-13(9-16)12-25-30-18;1-2-6-14(7-3-1)20-24-19-9-5-4-8-17(19)21(25-20)23-16-10-11-18-15(12-16)13-22-26-18;1-27-7-6-21-20-24-16-10-18(29-3)17(28-2)9-14(16)19(25-20)23-13-4-5-15-12(8-13)11-22-26-15;1-27-17-8-14-16(9-18(17)28-2)24-20(23-12-3-4-12)25-19(14)22-13-5-6-15-11(7-13)10-21-26-15;1-24-14-6-11-13(7-15(14)25-2)21-17(18)22-16(11)20-10-3-4-12-9(5-10)8-19-23-12/h3-12H,1-2H3,(H,25,30)(H2,26,27,28,29);1-13H,(H,22,26)(H,23,24,25);4-5,8-11H,6-7H2,1-3H3,(H,22,26)(H2,21,23,24,25);5-10,12H,3-4H2,1-2H3,(H,21,26)(H2,22,23,24,25);3-8H,1-2H3,(H,19,23)(H,20,21,22)
InChIKeyAGTPNYWKFGYONL-UHFFFAOYSA-N
XLogP21.15
TPSA451.61 Ų
H-Bond Donors13
H-Bond Acceptors32
Rotatable Bonds27
Heavy Atoms140
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001894.47
LogP ≤ 521.15
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine with MolForge

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Related Compounds

2-N,4-N-bis(1-benzylindazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine
CID 44532006
N-(3-(4-(1H-indazol-5-ylamino)-7-methoxy-6-(2-(pyrrolidin-1-yl)ethoxy)quinazolin-2-yl)phenyl)-2-morpholinoacetamide
CID 25011914
N-[3-[4-(1H-indazol-5-ylamino)-7-methoxy-6-(3-morpholin-4-ylpropoxy)quinazolin-2-yl]phenyl]butanamide
CID 25012569
N-[1-[3-amino-5-(trifluoromethyl)phenyl]ethyl]-7-methoxy-2-methyl-6-(oxolan-3-yloxy)quinazolin-4-amine;3-methyl-4-[4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine
CID 172055263
2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine
CID 10274283
N2-(3-fluorophenyl)-N4-(1H-indazol-5-yl)-6,7-dimethoxy-2,4-quinazolinediamine
CID 17967758
2-N-[(2,6-difluorophenyl)methyl]-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine
CID 17967769
2-N-[(2,5-difluorophenyl)methyl]-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine
CID 17967776
2-N-[(2,4-difluorophenyl)methyl]-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine
CID 17967778
N-[2-(4-fluorophenyl)-6,7-dimethoxy-4-quinazolinyl]-N-(1H-indazol-5-yl)amine
CID 23075198
2-(3-fluoro-4-(phenyl)phenyl)-N-(1H-indazol-5-yl)-7-methoxy-6-(2-(4-methylpiperazin-1-yl)ethoxy)quinazolin-4-amine
CID 25013867
6-(2-(dimethylamino)ethoxy)-2-(3-fluoro-4-(phenyl)phenyl)-N-(1H-indazol-5-yl)-7-methoxyquinazolin-4-amine
CID 25013868

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine?
The IUPAC name of 2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine (CID 157110281) is 2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine.
What is the SMILES notation for 2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine?
The canonical SMILES for 2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine is COCCNc1nc(Nc2ccc3[nH]ncc3c2)c2cc(OC)c(OC)cc2n1.COc1cc2nc(Cl)nc(Nc3ccc4[nH]ncc4c3)c2cc1OC.COc1cc2nc(NC3CC3)nc(Nc3ccc4[nH]ncc4c3)c2cc1OC.COc1cc2nc(Nc3ccc(F)cc3)nc(Nc3ccc4[nH]ncc4c3)c2cc1OC.c1ccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3ccccc3n2)cc1.
What is the InChIKey of 2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine?
The InChIKey is AGTPNYWKFGYONL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19FN6O2.C21H15N5.C20H22N6O3.C20H20N6O2.C17H14ClN5O2/c1-31-20-10-17-19(11-21(20)32-2)28-23(27-15-5-3-14(24)4-6-15)29-22(17)26-16-7-8-18-13(9-16)12-25-30-18;1-2-6-14(7-3-1)20-24-19-9-5-4-8-17(19)21(25-20)23-16-10-11-18-15(12-16)13-22-26-18;1-27-7-6-21-20-24-16-10-18(29-3)17(28-2)9-14(16)19(25-20)23-13-4-5-15-12(8-13)11-22-26-15;1-27-17-8-14-16(9-18(17)28-2)24-20(23-12-3-4-12)25-19(14)22-13-5-6-15-11(7-13)10-21-26-15;1-24-14-6-11-13(7-15(14)25-2)21-17(18)22-16(11)20-10-3-4-12-9(5-10)8-19-23-12/h3-12H,1-2H3,(H,25,30)(H2,26,27,28,29);1-13H,(H,22,26)(H,23,24,25);4-5,8-11H,6-7H2,1-3H3,(H,22,26)(H2,21,23,24,25);5-10,12H,3-4H2,1-2H3,(H,21,26)(H2,22,23,24,25);3-8H,1-2H3,(H,19,23)(H,20,21,22).
What are the key properties of 2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine?
2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine has a molecular weight of 1894.47 g/mol, XLogP of 21.15, 27 rotatable bonds, 13 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine;2-N-cyclopropyl-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;2-N-(4-fluorophenyl)-4-N-(1H-indazol-5-yl)-6,7-dimethoxyquinazoline-2,4-diamine;4-N-(1H-indazol-5-yl)-6,7-dimethoxy-2-N-(2-methoxyethyl)quinazoline-2,4-diamine;N-(1H-indazol-5-yl)-2-phenylquinazolin-4-amine is sourced from PubChem (CID 157110281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).