2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine

C82H64Cl2F6N16 — CID 158012971

IUPAC2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine
SMILESCc1cc(Nc2cc(-c3ccccc3C(F)(F)F)nc3ccccc23)n[nH]1.Cc1cc(Nc2cc(-c3ccccc3Cl)nc3ccccc23)n[nH]1.Clc1ccccc1-c1cc(Nc2cc(C3CC3)[nH]n2)c2ccccc2n1.FC(F)(F)c1ccccc1-c1cc(Nc2cc(C3CC3)[nH]n2)c2ccccc2n1
InChIInChI=1S/C22H17F3N4.C21H17ClN4.C20H15F3N4.C19H15ClN4/c23-22(24,25)16-7-3-1-5-14(16)19-11-20(15-6-2-4-8-17(15)26-19)27-21-12-18(28-29-21)13-9-10-13;22-16-7-3-1-5-14(16)19-11-20(15-6-2-4-8-17(15)23-19)24-21-12-18(25-26-21)13-9-10-13;1-12-10-19(27-26-12)25-18-11-17(24-16-9-5-3-7-14(16)18)13-6-2-4-8-15(13)20(21,22)23;1-12-10-19(24-23-12)22-18-11-17(13-6-2-4-8-15(13)20)21-16-9-5-3-7-14(16)18/h1-8,11-13H,9-10H2,(H2,26,27,28,29);1-8,11-13H,9-10H2,(H2,23,24,25,26);2-11H,1H3,(H2,24,25,26,27);2-11H,1H3,(H2,21,22,23,24)
InChIKeyFFCSSGQCEKBUEB-UHFFFAOYSA-N
MW1458.42 g/mol
LogP23.19
Rot. Bonds14

About 2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine

2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine (PubChem CID 158012971) has the molecular formula C82H64Cl2F6N16 and a molecular weight of 1458.42 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine
PubChem CID158012971
Molecular FormulaC82H64Cl2F6N16
Molecular Weight1458.42 g/mol
Exact Mass1456.48
IUPAC Name2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine
SMILESCc1cc(Nc2cc(-c3ccccc3C(F)(F)F)nc3ccccc23)n[nH]1.Cc1cc(Nc2cc(-c3ccccc3Cl)nc3ccccc23)n[nH]1.Clc1ccccc1-c1cc(Nc2cc(C3CC3)[nH]n2)c2ccccc2n1.FC(F)(F)c1ccccc1-c1cc(Nc2cc(C3CC3)[nH]n2)c2ccccc2n1
InChIInChI=1S/C22H17F3N4.C21H17ClN4.C20H15F3N4.C19H15ClN4/c23-22(24,25)16-7-3-1-5-14(16)19-11-20(15-6-2-4-8-17(15)26-19)27-21-12-18(28-29-21)13-9-10-13;22-16-7-3-1-5-14(16)19-11-20(15-6-2-4-8-17(15)23-19)24-21-12-18(25-26-21)13-9-10-13;1-12-10-19(27-26-12)25-18-11-17(24-16-9-5-3-7-14(16)18)13-6-2-4-8-15(13)20(21,22)23;1-12-10-19(24-23-12)22-18-11-17(13-6-2-4-8-15(13)20)21-16-9-5-3-7-14(16)18/h1-8,11-13H,9-10H2,(H2,26,27,28,29);1-8,11-13H,9-10H2,(H2,23,24,25,26);2-11H,1H3,(H2,24,25,26,27);2-11H,1H3,(H2,21,22,23,24)
InChIKeyFFCSSGQCEKBUEB-UHFFFAOYSA-N
XLogP23.19
TPSA214.40 Ų
H-Bond Donors8
H-Bond Acceptors12
Rotatable Bonds14
Heavy Atoms106
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001458.42
LogP ≤ 523.19
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1012

Analyze 2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine with MolForge

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Related Compounds

N-[6-(2-chlorophenyl)-2,3-dimethyl-4-pyridinyl]-1H-indazol-3-amine;N-[2,3-dimethyl-6-[2-(trifluoromethyl)phenyl]-4-pyridinyl]-5-fluoro-1H-indazol-3-amine;N-[2,3-dimethyl-6-[2-(trifluoromethyl)phenyl]-4-pyridinyl]-1H-indazol-3-amine
CID 157053794
7-(2-chlorophenyl)-N-(1H-indazol-3-yl)-1,6-naphthyridin-5-amine;3-(2-chlorophenyl)-N-(1H-indazol-3-yl)-5,6,7,8-tetrahydroisoquinolin-1-amine;N-(5-fluoro-1H-indazol-3-yl)-3-[2-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroisoquinolin-1-amine;N-(1H-indazol-3-yl)-3-[2-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroisoquinolin-1-amine
CID 157212739
N-[4-(2-chlorophenyl)-6-cyclohexylpyrimidin-2-yl]-1H-indazol-3-amine;N-[4-cyclohexyl-6-[2-(trifluoromethyl)phenyl]pyrimidin-2-yl]-1H-indazol-3-amine;5,7-difluoro-N-[4-phenyl-6-[2-(trifluoromethyl)phenyl]pyrimidin-2-yl]-1H-indazol-3-amine;N-[4-phenyl-6-[2-(trifluoromethyl)phenyl]pyrimidin-2-yl]-1H-indazol-3-amine
CID 157322578
N-[2-(2-chlorophenyl)-5,6-dimethylpyrimidin-4-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[2-(2-chlorophenyl)-6-methylpyrimidin-4-yl]-5-fluoro-1H-indazol-3-amine;N-[5-ethyl-6-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-5-fluoro-1H-indazol-3-amine;N-[6-methyl-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 157337387
2-cyclohexyl-N-(5-methyl-1H-pyrazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridin-4-amine;N-[2-cyclohexyl-6-[2-(trifluoromethyl)phenyl]-4-pyridinyl]-1H-indazol-3-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-piperidin-4-yl-6-[2-(trifluoromethyl)phenyl]pyridin-4-amine;N-[2-piperidin-4-yl-6-[2-(trifluoromethyl)phenyl]-4-pyridinyl]-1H-indazol-3-amine
CID 157392101
3-(2-chlorophenyl)-N-(1H-indazol-3-yl)-5,6,7,8-tetrahydroisoquinolin-1-amine;N-(5-fluoro-1H-indazol-3-yl)-3-[2-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroisoquinolin-1-amine;5-fluoro-N-[4-phenyl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;N-(1H-indazol-3-yl)-3-[2-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroisoquinolin-1-amine
CID 157482676
N-[2-(2-chlorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]-5,7-difluoro-1H-indazol-3-amine;N-[2-(2-chlorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]-7-fluoro-1H-indazol-3-amine;N-[2-(2-chlorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]-1H-indazol-3-amine;N-(1H-indazol-3-yl)-2-[2-(trifluoromethyl)phenyl]-5,6,7,8,9,10-hexahydrocycloocta[d]pyrimidin-4-amine
CID 157768311
N-[5-(2-chlorophenyl)-1,2,4-triazin-3-yl]-5-fluoro-1H-indazol-3-amine;N-[5-(2-chlorophenyl)-1,2,4-triazin-3-yl]-1H-indazol-3-amine;bis(N-[6-cyclopropyl-3-[2-(trifluoromethyl)phenyl]-1,2,4-triazin-5-yl]-1H-indazol-3-amine)
CID 157921784
N-[4-(2-chlorophenyl)-6-cyclohexylpyrimidin-2-yl]-5-fluoro-1H-indazol-3-amine;N-[4-(2-chlorophenyl)-6-piperidin-1-ylpyrimidin-2-yl]-5-fluoro-1H-indazol-3-amine;N-[4-(2-chlorophenyl)-6-piperidin-1-ylpyrimidin-2-yl]-1H-indazol-3-amine;N-[4-cyclohexyl-6-[2-(trifluoromethyl)phenyl]pyrimidin-2-yl]-5-fluoro-1H-indazol-3-amine
CID 157974937
N-[2-(2-chlorophenyl)-6-methyl-4-pyridinyl]-5-fluoro-1H-indazol-3-amine;N-[2-(2-chlorophenyl)-6-phenyl-4-pyridinyl]-1H-indazol-3-amine;5-fluoro-N-[2-phenyl-6-[2-(trifluoromethyl)phenyl]-4-pyridinyl]-1H-indazol-3-amine;N-[2-phenyl-6-[2-(trifluoromethyl)phenyl]-4-pyridinyl]-1H-indazol-3-amine
CID 158117055
N-(5,7-difluoro-1H-indazol-3-yl)-3-[2-(trifluoromethyl)phenyl]isoquinolin-1-amine;N-(1H-indazol-3-yl)-2-phenylquinolin-4-amine;N-(1H-indazol-3-yl)-3-[2-(trifluoromethyl)phenyl]isoquinolin-1-amine;N-(5-methyl-1H-pyrazol-3-yl)-3-phenylisoquinolin-1-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-phenylquinolin-4-amine
CID 158746811
2-(3-chloro-4-fluorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;2-(3,5-difluorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine;3-[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]benzonitrile;N-(5-methyl-1H-pyrazol-3-yl)-2-(3-propan-2-ylphenyl)quinazolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[3-(trifluoromethyl)phenyl]quinazolin-4-amine
CID 158788400

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine?
The IUPAC name of 2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine (CID 158012971) is 2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine.
What is the SMILES notation for 2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine?
The canonical SMILES for 2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine is Cc1cc(Nc2cc(-c3ccccc3C(F)(F)F)nc3ccccc23)n[nH]1.Cc1cc(Nc2cc(-c3ccccc3Cl)nc3ccccc23)n[nH]1.Clc1ccccc1-c1cc(Nc2cc(C3CC3)[nH]n2)c2ccccc2n1.FC(F)(F)c1ccccc1-c1cc(Nc2cc(C3CC3)[nH]n2)c2ccccc2n1.
What is the InChIKey of 2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine?
The InChIKey is FFCSSGQCEKBUEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17F3N4.C21H17ClN4.C20H15F3N4.C19H15ClN4/c23-22(24,25)16-7-3-1-5-14(16)19-11-20(15-6-2-4-8-17(15)26-19)27-21-12-18(28-29-21)13-9-10-13;22-16-7-3-1-5-14(16)19-11-20(15-6-2-4-8-17(15)23-19)24-21-12-18(25-26-21)13-9-10-13;1-12-10-19(27-26-12)25-18-11-17(24-16-9-5-3-7-14(16)18)13-6-2-4-8-15(13)20(21,22)23;1-12-10-19(24-23-12)22-18-11-17(13-6-2-4-8-15(13)20)21-16-9-5-3-7-14(16)18/h1-8,11-13H,9-10H2,(H2,26,27,28,29);1-8,11-13H,9-10H2,(H2,23,24,25,26);2-11H,1H3,(H2,24,25,26,27);2-11H,1H3,(H2,21,22,23,24).
What are the key properties of 2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine?
2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine has a molecular weight of 1458.42 g/mol, XLogP of 23.19, 14 rotatable bonds, 8 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)quinolin-4-amine;2-(2-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)quinolin-4-amine;N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine;N-(5-methyl-1H-pyrazol-3-yl)-2-[2-(trifluoromethyl)phenyl]quinolin-4-amine is sourced from PubChem (CID 158012971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).