N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide

C73H55Cl2F5N20O6 — CID 157382236

IUPACN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide
SMILESCOc1cc(C)ccc1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.COc1cc(Cl)ccc1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.Cc1c(F)ccc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc12.Cc1cc(Cl)cc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc12
InChIInChI=1S/C19H17N5O2.C18H12ClF2N5O.C18H14ClN5O2.C18H12F3N5O/c1-11-7-8-12(16(9-11)26-2)19(25)23-15-10-20-24-17(15)18-21-13-5-3-4-6-14(13)22-18;1-8-5-9(19)6-12-15(8)25-17(23-12)16-13(7-22-26-16)24-18(27)14-10(20)3-2-4-11(14)21;1-26-15-8-10(19)6-7-11(15)18(25)23-14-9-20-24-16(14)17-21-12-4-2-3-5-13(12)22-17;1-8-9(19)5-6-12-15(8)25-17(23-12)16-13(7-22-26-16)24-18(27)14-10(20)3-2-4-11(14)21/h3-10H,1-2H3,(H,20,24)(H,21,22)(H,23,25);2-7H,1H3,(H,22,26)(H,23,25)(H,24,27);2-9H,1H3,(H,20,24)(H,21,22)(H,23,25);2-7H,1H3,(H,22,26)(H,23,25)(H,24,27)
InChIKeyBLAAJXHPAYQLNY-UHFFFAOYSA-N
MW1474.27 g/mol
LogP15.77
Rot. Bonds14

About N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide

N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide (PubChem CID 157382236) has the molecular formula C73H55Cl2F5N20O6 and a molecular weight of 1474.27 g/mol. Its IUPAC name is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide.

Molecular Properties

Compound NameN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide
PubChem CID157382236
Molecular FormulaC73H55Cl2F5N20O6
Molecular Weight1474.27 g/mol
Exact Mass1472.39
IUPAC NameN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide
SMILESCOc1cc(C)ccc1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.COc1cc(Cl)ccc1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.Cc1c(F)ccc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc12.Cc1cc(Cl)cc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc12
InChIInChI=1S/C19H17N5O2.C18H12ClF2N5O.C18H14ClN5O2.C18H12F3N5O/c1-11-7-8-12(16(9-11)26-2)19(25)23-15-10-20-24-17(15)18-21-13-5-3-4-6-14(13)22-18;1-8-5-9(19)6-12-15(8)25-17(23-12)16-13(7-22-26-16)24-18(27)14-10(20)3-2-4-11(14)21;1-26-15-8-10(19)6-7-11(15)18(25)23-14-9-20-24-16(14)17-21-12-4-2-3-5-13(12)22-17;1-8-9(19)5-6-12-15(8)25-17(23-12)16-13(7-22-26-16)24-18(27)14-10(20)3-2-4-11(14)21/h3-10H,1-2H3,(H,20,24)(H,21,22)(H,23,25);2-7H,1H3,(H,22,26)(H,23,25)(H,24,27);2-9H,1H3,(H,20,24)(H,21,22)(H,23,25);2-7H,1H3,(H,22,26)(H,23,25)(H,24,27)
InChIKeyBLAAJXHPAYQLNY-UHFFFAOYSA-N
XLogP15.77
TPSA364.30 Ų
H-Bond Donors12
H-Bond Acceptors14
Rotatable Bonds14
Heavy Atoms106
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001474.27
LogP ≤ 515.77
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1014

Analyze N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide?
The IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide (CID 157382236) is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide.
What is the SMILES notation for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide?
The canonical SMILES for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide is COc1cc(C)ccc1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.COc1cc(Cl)ccc1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.Cc1c(F)ccc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc12.Cc1cc(Cl)cc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc12.
What is the InChIKey of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide?
The InChIKey is BLAAJXHPAYQLNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2.C18H12ClF2N5O.C18H14ClN5O2.C18H12F3N5O/c1-11-7-8-12(16(9-11)26-2)19(25)23-15-10-20-24-17(15)18-21-13-5-3-4-6-14(13)22-18;1-8-5-9(19)6-12-15(8)25-17(23-12)16-13(7-22-26-16)24-18(27)14-10(20)3-2-4-11(14)21;1-26-15-8-10(19)6-7-11(15)18(25)23-14-9-20-24-16(14)17-21-12-4-2-3-5-13(12)22-17;1-8-9(19)5-6-12-15(8)25-17(23-12)16-13(7-22-26-16)24-18(27)14-10(20)3-2-4-11(14)21/h3-10H,1-2H3,(H,20,24)(H,21,22)(H,23,25);2-7H,1H3,(H,22,26)(H,23,25)(H,24,27);2-9H,1H3,(H,20,24)(H,21,22)(H,23,25);2-7H,1H3,(H,22,26)(H,23,25)(H,24,27).
What are the key properties of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide?
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide has a molecular weight of 1474.27 g/mol, XLogP of 15.77, 14 rotatable bonds, 12 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-chloro-2-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxy-4-methylbenzamide;N-[5-(6-chloro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(5-fluoro-4-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide is sourced from PubChem (CID 157382236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).