N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine

C64H50N22O2 — CID 91203218

IUPACN-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine
SMILESCc1cc(Nc2ncnc3ccccc23)n[nH]1.O=c1oc2ccc(Nc3nc(Nc4ccn[nH]4)c4ccccc4n3)cc2c2ccccc12.c1ccc(Nc2nc(Nc3ccn[nH]3)c3ccccc3n2)cc1.c1ccc2c(Nc3ccn[nH]3)ncnc2c1
InChIInChI=1S/C24H16N6O2.C17H14N6.C12H11N5.C11H9N5/c31-23-16-6-2-1-5-15(16)18-13-14(9-10-20(18)32-23)26-24-27-19-8-4-3-7-17(19)22(29-24)28-21-11-12-25-30-21;1-2-6-12(7-3-1)19-17-20-14-9-5-4-8-13(14)16(22-17)21-15-10-11-18-23-15;1-8-6-11(17-16-8)15-12-9-4-2-3-5-10(9)13-7-14-12;1-2-4-9-8(3-1)11(13-7-12-9)15-10-5-6-14-16-10/h1-13H,(H3,25,26,27,28,29,30);1-11H,(H3,18,19,20,21,22,23);2-7H,1H3,(H2,13,14,15,16,17);1-7H,(H2,12,13,14,15,16)
InChIKeyFFAXDYIYWXHTTJ-UHFFFAOYSA-N
MW1159.26 g/mol
LogP13.44
Rot. Bonds12

About N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine

N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine (PubChem CID 91203218) has the molecular formula C64H50N22O2 and a molecular weight of 1159.26 g/mol. Its IUPAC name is N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine.

Molecular Properties

Compound NameN-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine
PubChem CID91203218
Molecular FormulaC64H50N22O2
Molecular Weight1159.26 g/mol
Exact Mass1158.45
IUPAC NameN-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine
SMILESCc1cc(Nc2ncnc3ccccc23)n[nH]1.O=c1oc2ccc(Nc3nc(Nc4ccn[nH]4)c4ccccc4n3)cc2c2ccccc12.c1ccc(Nc2nc(Nc3ccn[nH]3)c3ccccc3n2)cc1.c1ccc2c(Nc3ccn[nH]3)ncnc2c1
InChIInChI=1S/C24H16N6O2.C17H14N6.C12H11N5.C11H9N5/c31-23-16-6-2-1-5-15(16)18-13-14(9-10-20(18)32-23)26-24-27-19-8-4-3-7-17(19)22(29-24)28-21-11-12-25-30-21;1-2-6-12(7-3-1)19-17-20-14-9-5-4-8-13(14)16(22-17)21-15-10-11-18-23-15;1-8-6-11(17-16-8)15-12-9-4-2-3-5-10(9)13-7-14-12;1-2-4-9-8(3-1)11(13-7-12-9)15-10-5-6-14-16-10/h1-13H,(H3,25,26,27,28,29,30);1-11H,(H3,18,19,20,21,22,23);2-7H,1H3,(H2,13,14,15,16,17);1-7H,(H2,12,13,14,15,16)
InChIKeyFFAXDYIYWXHTTJ-UHFFFAOYSA-N
XLogP13.44
TPSA320.23 Ų
H-Bond Donors10
H-Bond Acceptors20
Rotatable Bonds12
Heavy Atoms88
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001159.26
LogP ≤ 513.44
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine with MolForge

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Related Compounds

2-[3,5-bis(trifluoromethyl)phenyl]-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;1-[3-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]phenyl]ethanone;[3-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]phenyl]methanol;N-(5-methyl-1H-pyrazol-3-yl)-2-(3-phenoxyphenyl)quinazolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-pyridin-3-ylquinazolin-4-amine
CID 162098145
2-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]amino]benzo[c]chromen-6-one
CID 20604146
2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one
CID 20604308
N-(2-methoxy-5-phenylphenyl)-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;N-(2-methoxy-5-phenylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine;1-[3-[4-(2-methyl-5-phenylanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]ethanone;1-[3-[4-(4-phenoxyanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]ethanone
CID 157668389
1-[3-[4-(2-methoxy-5-phenylanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]ethanone;N-(2-methoxy-5-phenylphenyl)-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;N-(2-methoxy-5-phenylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine;1-[3-[4-(4-phenoxyanilino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]ethanone
CID 159022454
Deuterio(iodo)methane;methyl 3-[[4-(4-aminonaphthalen-1-yl)oxypyrimidin-2-yl]amino]benzoate;methyl 3-[[4-[4-[[3-tert-butyl-1-(4-methylphenyl)pyrazol-5-yl]carbamoylamino]naphthalen-1-yl]oxypyrimidin-2-yl]amino]benzoate;1-[2-(4-methylphenyl)pyrazolidin-3-yl]-3-naphthalen-1-ylurea;methyl 3-(pyrimidin-2-ylamino)benzoate
CID 159835984
1H-benzimidazole;1-benzofuran;1H-indole;2H-isoindole;isoquinoline;phthalazine;pyrazine;pyridazine;pyrimidine;quinazoline;quinoline
CID 161207664
N-[(4-cyano-3-fluorophenyl)methyl]-2-methyl-3-[7-(1-methylpyrazol-4-yl)quinolin-4-yl]oxybenzamide;N-[(4-cyano-3-fluorophenyl)methyl]-2-methyl-3-(7-pyrimidin-5-ylquinolin-4-yl)oxybenzamide;N-[(2,6-difluoro-4-pyridinyl)methyl]-2-methyl-3-(7-pyrimidin-5-ylquinolin-4-yl)oxybenzamide;3-[7-(1-ethyl-3,5-dimethylpyrazol-4-yl)quinolin-4-yl]oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-[7-(2-methoxypyrimidin-5-yl)quinolin-4-yl]oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-[7-(1H-pyrazol-4-yl)quinolin-4-yl]oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-(7-pyrimidin-5-ylquinolin-4-yl)oxybenzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(1,3,5-trimethylpyrazol-4-yl)quinolin-4-yl]oxybenzamide
CID 167578755
3-[7-(1,5-dimethylpyrazol-4-yl)quinolin-4-yl]oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-[7-(1-ethyl-3,5-dimethylpyrazol-4-yl)quinolin-4-yl]oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-[7-(1H-pyrazol-4-yl)quinolin-4-yl]oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-(7-pyrimidin-5-ylquinolin-4-yl)oxybenzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(1,3,5-trimethylpyrazol-4-yl)quinolin-4-yl]oxybenzamide
CID 167633693

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine?
The IUPAC name of N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine (CID 91203218) is N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine.
What is the SMILES notation for N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine?
The canonical SMILES for N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine is Cc1cc(Nc2ncnc3ccccc23)n[nH]1.O=c1oc2ccc(Nc3nc(Nc4ccn[nH]4)c4ccccc4n3)cc2c2ccccc12.c1ccc(Nc2nc(Nc3ccn[nH]3)c3ccccc3n2)cc1.c1ccc2c(Nc3ccn[nH]3)ncnc2c1.
What is the InChIKey of N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine?
The InChIKey is FFAXDYIYWXHTTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N6O2.C17H14N6.C12H11N5.C11H9N5/c31-23-16-6-2-1-5-15(16)18-13-14(9-10-20(18)32-23)26-24-27-19-8-4-3-7-17(19)22(29-24)28-21-11-12-25-30-21;1-2-6-12(7-3-1)19-17-20-14-9-5-4-8-13(14)16(22-17)21-15-10-11-18-23-15;1-8-6-11(17-16-8)15-12-9-4-2-3-5-10(9)13-7-14-12;1-2-4-9-8(3-1)11(13-7-12-9)15-10-5-6-14-16-10/h1-13H,(H3,25,26,27,28,29,30);1-11H,(H3,18,19,20,21,22,23);2-7H,1H3,(H2,13,14,15,16,17);1-7H,(H2,12,13,14,15,16).
What are the key properties of N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine?
N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine has a molecular weight of 1159.26 g/mol, XLogP of 13.44, 12 rotatable bonds, 10 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-N-phenyl-4-N-(1H-pyrazol-5-yl)quinazoline-2,4-diamine;2-[[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]amino]benzo[c]chromen-6-one;N-(1H-pyrazol-5-yl)quinazolin-4-amine is sourced from PubChem (CID 91203218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).