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

C140H123N25O10 — CID 167633693

IUPAC3-[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
SMILESCCn1nc(C)c(-c2ccc3c(Oc4cccc(C(=O)NCc5ccncc5)c4C)ccnc3c2)c1C.Cc1c(Oc2ccnc3cc(-c4cn[nH]c4)ccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3cc(-c4cncnc4)ccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3cc(-c4cnn(C)c4C)ccc23)cccc1C(=O)NCc1ccncc1.Cc1nn(C)c(C)c1-c1ccc2c(Oc3cccc(C(=O)NCc4ccncc4)c3C)ccnc2c1
InChIInChI=1S/C30H29N5O2.C29H27N5O2.C28H25N5O2.C27H21N5O2.C26H21N5O2/c1-5-35-21(4)29(20(3)34-35)23-9-10-25-26(17-23)32-16-13-28(25)37-27-8-6-7-24(19(27)2)30(36)33-18-22-11-14-31-15-12-22;1-18-23(29(35)32-17-21-10-13-30-14-11-21)6-5-7-26(18)36-27-12-15-31-25-16-22(8-9-24(25)27)28-19(2)33-34(4)20(28)3;1-18-22(28(34)31-16-20-9-12-29-13-10-20)5-4-6-26(18)35-27-11-14-30-25-15-21(7-8-23(25)27)24-17-32-33(3)19(24)2;1-18-22(27(33)32-14-19-7-10-28-11-8-19)3-2-4-25(18)34-26-9-12-31-24-13-20(5-6-23(24)26)21-15-29-17-30-16-21;1-17-21(26(32)29-14-18-7-10-27-11-8-18)3-2-4-24(17)33-25-9-12-28-23-13-19(5-6-22(23)25)20-15-30-31-16-20/h6-17H,5,18H2,1-4H3,(H,33,36);5-16H,17H2,1-4H3,(H,32,35);4-15,17H,16H2,1-3H3,(H,31,34);2-13,15-17H,14H2,1H3,(H,32,33);2-13,15-16H,14H2,1H3,(H,29,32)(H,30,31)
InChIKeyODZRLRYBAPYTMK-UHFFFAOYSA-N
MW2315.69 g/mol
LogP27.38
Rot. Bonds31

About 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

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 (PubChem CID 167633693) has the molecular formula C140H123N25O10 and a molecular weight of 2315.69 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name3-[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
PubChem CID167633693
Molecular FormulaC140H123N25O10
Molecular Weight2315.69 g/mol
Exact Mass2313.99
IUPAC Name3-[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
SMILESCCn1nc(C)c(-c2ccc3c(Oc4cccc(C(=O)NCc5ccncc5)c4C)ccnc3c2)c1C.Cc1c(Oc2ccnc3cc(-c4cn[nH]c4)ccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3cc(-c4cncnc4)ccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3cc(-c4cnn(C)c4C)ccc23)cccc1C(=O)NCc1ccncc1.Cc1nn(C)c(C)c1-c1ccc2c(Oc3cccc(C(=O)NCc4ccncc4)c3C)ccnc2c1
InChIInChI=1S/C30H29N5O2.C29H27N5O2.C28H25N5O2.C27H21N5O2.C26H21N5O2/c1-5-35-21(4)29(20(3)34-35)23-9-10-25-26(17-23)32-16-13-28(25)37-27-8-6-7-24(19(27)2)30(36)33-18-22-11-14-31-15-12-22;1-18-23(29(35)32-17-21-10-13-30-14-11-21)6-5-7-26(18)36-27-12-15-31-25-16-22(8-9-24(25)27)28-19(2)33-34(4)20(28)3;1-18-22(28(34)31-16-20-9-12-29-13-10-20)5-4-6-26(18)35-27-11-14-30-25-15-21(7-8-23(25)27)24-17-32-33(3)19(24)2;1-18-22(27(33)32-14-19-7-10-28-11-8-19)3-2-4-25(18)34-26-9-12-31-24-13-20(5-6-23(24)26)21-15-29-17-30-16-21;1-17-21(26(32)29-14-18-7-10-27-11-8-18)3-2-4-24(17)33-25-9-12-28-23-13-19(5-6-22(23)25)20-15-30-31-16-20/h6-17H,5,18H2,1-4H3,(H,33,36);5-16H,17H2,1-4H3,(H,32,35);4-15,17H,16H2,1-3H3,(H,31,34);2-13,15-17H,14H2,1H3,(H,32,33);2-13,15-16H,14H2,1H3,(H,29,32)(H,30,31)
InChIKeyODZRLRYBAPYTMK-UHFFFAOYSA-N
XLogP27.38
TPSA428.47 Ų
H-Bond Donors6
H-Bond Acceptors29
Rotatable Bonds31
Heavy Atoms175
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002315.69
LogP ≤ 527.38
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1029

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CCn1nc(C)c(-c2ccc3c(Oc4cccc(C(=O)NCc5ccncc5)c4C)ccnc3c2)c1C.Cc1c(Oc2ccnc3cc(-c4cn[nH]c4)ccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3cc(-c4cncnc4)ccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3cc(-c4cnn(C)c4C)ccc23)cccc1C(=O)NCc1ccncc1.Cc1nn(C)c(C)c1-c1ccc2c(Oc3cccc(C(=O)NCc4ccncc4)c3C)ccnc2c1.
What is the InChIKey of 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?
The InChIKey is ODZRLRYBAPYTMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H29N5O2.C29H27N5O2.C28H25N5O2.C27H21N5O2.C26H21N5O2/c1-5-35-21(4)29(20(3)34-35)23-9-10-25-26(17-23)32-16-13-28(25)37-27-8-6-7-24(19(27)2)30(36)33-18-22-11-14-31-15-12-22;1-18-23(29(35)32-17-21-10-13-30-14-11-21)6-5-7-26(18)36-27-12-15-31-25-16-22(8-9-24(25)27)28-19(2)33-34(4)20(28)3;1-18-22(28(34)31-16-20-9-12-29-13-10-20)5-4-6-26(18)35-27-11-14-30-25-15-21(7-8-23(25)27)24-17-32-33(3)19(24)2;1-18-22(27(33)32-14-19-7-10-28-11-8-19)3-2-4-25(18)34-26-9-12-31-24-13-20(5-6-23(24)26)21-15-29-17-30-16-21;1-17-21(26(32)29-14-18-7-10-27-11-8-18)3-2-4-24(17)33-25-9-12-28-23-13-19(5-6-22(23)25)20-15-30-31-16-20/h6-17H,5,18H2,1-4H3,(H,33,36);5-16H,17H2,1-4H3,(H,32,35);4-15,17H,16H2,1-3H3,(H,31,34);2-13,15-17H,14H2,1H3,(H,32,33);2-13,15-16H,14H2,1H3,(H,29,32)(H,30,31).
What are the key properties of 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?
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 has a molecular weight of 2315.69 g/mol, XLogP of 27.38, 31 rotatable bonds, 6 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 167633693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).