4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide

C79H72Cl2F2N18O6 — CID 160940678

About 4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide

4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide (PubChem CID 160940678) has the molecular formula C79H72Cl2F2N18O6 and a molecular weight of 1478.47 g/mol. Its IUPAC name is 4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide.

Molecular Properties

• Compound Name: 4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide
• PubChem CID: 160940678
• Molecular Formula: C79H72Cl2F2N18O6
• Molecular Weight: 1478.47 g/mol
• Exact Mass: 1476.52
• IUPAC Name: 4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide
• SMILES: CCC(=O)Nc1cncc(-n2cc(-c3cc(C(=O)NC4CC4)ccc3C)cn2)c1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cncc(NC(=O)CF)c2)c1.O=C(NC1CC1)c1cc(-c2cnn(-c3cccnc3)c2)c(Cl)cc1F.O=C(NC1CC1)c1ccc(Cl)c(-c2cnn(-c3cccnc3)c2)c1
• InChI: InChI=1S/C22H23N5O2.C21H20FN5O2.C18H14ClFN4O.C18H15ClN4O/c1-3-21(28)25-18-9-19(12-23-11-18)27-13-16(10-24-27)20-8-15(5-4-14(20)2)22(29)26-17-6-7-17;1-13-2-3-14(21(29)26-16-4-5-16)6-19(13)15-9-24-27(12-15)18-7-17(10-23-11-18)25-20(28)8-22;19-16-7-17(20)15(18(25)23-12-3-4-12)6-14(16)11-8-22-24(10-11)13-2-1-5-21-9-13;19-17-6-3-12(18(24)22-14-4-5-14)8-16(17)13-9-21-23(11-13)15-2-1-7-20-10-15/h4-5,8-13,17H,3,6-7H2,1-2H3,(H,25,28)(H,26,29);2-3,6-7,9-12,16H,4-5,8H2,1H3,(H,25,28)(H,26,29);1-2,5-10,12H,3-4H2,(H,23,25);1-3,6-11,14H,4-5H2,(H,22,24)
• InChIKey: SULVMTZZRHRMII-UHFFFAOYSA-N
• XLogP: 13.63
• TPSA: 297.44 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 18
• Rotatable Bonds: 20
• Heavy Atoms: 107
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1478.47
LogP ≤ 5	13.63
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide?

The IUPAC name of 4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide (CID 160940678) is 4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide.

What is the SMILES notation for 4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide?

The canonical SMILES for 4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide is CCC(=O)Nc1cncc(-n2cc(-c3cc(C(=O)NC4CC4)ccc3C)cn2)c1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cncc(NC(=O)CF)c2)c1.O=C(NC1CC1)c1cc(-c2cnn(-c3cccnc3)c2)c(Cl)cc1F.O=C(NC1CC1)c1ccc(Cl)c(-c2cnn(-c3cccnc3)c2)c1.

What is the InChIKey of 4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide?

The InChIKey is SULVMTZZRHRMII-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O2.C21H20FN5O2.C18H14ClFN4O.C18H15ClN4O/c1-3-21(28)25-18-9-19(12-23-11-18)27-13-16(10-24-27)20-8-15(5-4-14(20)2)22(29)26-17-6-7-17;1-13-2-3-14(21(29)26-16-4-5-16)6-19(13)15-9-24-27(12-15)18-7-17(10-23-11-18)25-20(28)8-22;19-16-7-17(20)15(18(25)23-12-3-4-12)6-14(16)11-8-22-24(10-11)13-2-1-5-21-9-13;19-17-6-3-12(18(24)22-14-4-5-14)8-16(17)13-9-21-23(11-13)15-2-1-7-20-10-15/h4-5,8-13,17H,3,6-7H2,1-2H3,(H,25,28)(H,26,29);2-3,6-7,9-12,16H,4-5,8H2,1H3,(H,25,28)(H,26,29);1-2,5-10,12H,3-4H2,(H,23,25);1-3,6-11,14H,4-5H2,(H,22,24).

What are the key properties of 4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide?

4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide has a molecular weight of 1478.47 g/mol, XLogP of 13.63, 20 rotatable bonds, 6 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-N-cyclopropyl-2-fluoro-5-(1-pyridin-3-ylpyrazol-4-yl)benzamide;4-chloro-N-cyclopropyl-3-(1-pyridin-3-ylpyrazol-4-yl)benzamide;N-cyclopropyl-3-[1-[5-[(2-fluoroacetyl)amino]-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-[5-(propanoylamino)-3-pyridinyl]pyrazol-4-yl]benzamide is sourced from PubChem (CID 160940678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).