N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide

C81H73F3N22O7 — CID 158797257

IUPACN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
SMILESCOc1cccc(C(=O)Nc2cn[nH]c2-c2nc3ccccc3[nH]2)c1.Cc1cccc(C(=O)Nc2cn[nH]c2-c2nc3ccccc3[nH]2)c1F.O=C(Nc1cn[nH]c1-c1nc2ccc(CN3CCOCC3)cc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1ccccc1OCCN1CCCC1
InChIInChI=1S/C23H24N6O2.C22H20F2N6O2.C18H14FN5O.C18H15N5O2/c30-23(16-7-1-4-10-20(16)31-14-13-29-11-5-6-12-29)27-19-15-24-28-21(19)22-25-17-8-2-3-9-18(17)26-22;23-14-2-1-3-15(24)19(14)22(31)28-18-11-25-29-20(18)21-26-16-5-4-13(10-17(16)27-21)12-30-6-8-32-9-7-30;1-10-5-4-6-11(15(10)19)18(25)23-14-9-20-24-16(14)17-21-12-7-2-3-8-13(12)22-17;1-25-12-6-4-5-11(9-12)18(24)22-15-10-19-23-16(15)17-20-13-7-2-3-8-14(13)21-17/h1-4,7-10,15H,5-6,11-14H2,(H,24,28)(H,25,26)(H,27,30);1-5,10-11H,6-9,12H2,(H,25,29)(H,26,27)(H,28,31);2-9H,1H3,(H,20,24)(H,21,22)(H,23,25);2-10H,1H3,(H,19,23)(H,20,21)(H,22,24)
InChIKeyITAATAUZVSRQIG-UHFFFAOYSA-N
MW1523.62 g/mol
LogP13.86
Rot. Bonds19

About N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide

N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide (PubChem CID 158797257) has the molecular formula C81H73F3N22O7 and a molecular weight of 1523.62 g/mol. Its IUPAC name is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide.

Molecular Properties

Compound NameN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
PubChem CID158797257
Molecular FormulaC81H73F3N22O7
Molecular Weight1523.62 g/mol
Exact Mass1522.60
IUPAC NameN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
SMILESCOc1cccc(C(=O)Nc2cn[nH]c2-c2nc3ccccc3[nH]2)c1.Cc1cccc(C(=O)Nc2cn[nH]c2-c2nc3ccccc3[nH]2)c1F.O=C(Nc1cn[nH]c1-c1nc2ccc(CN3CCOCC3)cc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1ccccc1OCCN1CCCC1
InChIInChI=1S/C23H24N6O2.C22H20F2N6O2.C18H14FN5O.C18H15N5O2/c30-23(16-7-1-4-10-20(16)31-14-13-29-11-5-6-12-29)27-19-15-24-28-21(19)22-25-17-8-2-3-9-18(17)26-22;23-14-2-1-3-15(24)19(14)22(31)28-18-11-25-29-20(18)21-26-16-5-4-13(10-17(16)27-21)12-30-6-8-32-9-7-30;1-10-5-4-6-11(15(10)19)18(25)23-14-9-20-24-16(14)17-21-12-7-2-3-8-13(12)22-17;1-25-12-6-4-5-11(9-12)18(24)22-15-10-19-23-16(15)17-20-13-7-2-3-8-14(13)21-17/h1-4,7-10,15H,5-6,11-14H2,(H,24,28)(H,25,26)(H,27,30);1-5,10-11H,6-9,12H2,(H,25,29)(H,26,27)(H,28,31);2-9H,1H3,(H,20,24)(H,21,22)(H,23,25);2-10H,1H3,(H,19,23)(H,20,21)(H,22,24)
InChIKeyITAATAUZVSRQIG-UHFFFAOYSA-N
XLogP13.86
TPSA380.01 Ų
H-Bond Donors12
H-Bond Acceptors17
Rotatable Bonds19
Heavy Atoms113
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001523.62
LogP ≤ 513.86
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1017

Analyze N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide with MolForge

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Related Compounds

2-fluoro-6-methoxy-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
CID 136073241
N-[3-(5-morpholin-4-ylmethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-trifluoromethoxy-benzamide
CID 136073345
2-methoxy-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-5-(trifluoromethoxy)benzamide
CID 136073485
5-methyl-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2-(trifluoromethyl)furan-3-carboxamide
CID 136073514
N-{3-[6-ethoxy-5-(morpholine-4-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl}-2,6-difluoro-benzamide
CID 136073522
2-methoxy-6-methyl-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-(trifluoromethyl)benzamide
CID 136092133
1-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]ethanone
CID 136147613
4-fluoro-2-methoxy-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
CID 136175271
N-[5-[5-ethoxy-6-(piperidine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide
CID 136179820
2-fluoro-6-methoxy-N-[1-(4-methoxy-benzyl)-3-(5-morpholin-4-ylmethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-benzamide
CID 136395578
N-[1-(4-methoxy-benzyl)-3-(5-morpholin-4-ylmethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-trifluoromethoxy-benzamide
CID 136395579
2-methoxy-N-[5-[5-(morpholin-4-ylmethyl)-6,7-dihydro-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-5-(trifluoromethoxy)benzamide
CID 136465124

Frequently Asked Questions

What is the IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide?
The IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide (CID 158797257) is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-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]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide?
The canonical SMILES for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide is COc1cccc(C(=O)Nc2cn[nH]c2-c2nc3ccccc3[nH]2)c1.Cc1cccc(C(=O)Nc2cn[nH]c2-c2nc3ccccc3[nH]2)c1F.O=C(Nc1cn[nH]c1-c1nc2ccc(CN3CCOCC3)cc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1ccccc1OCCN1CCCC1.
What is the InChIKey of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide?
The InChIKey is ITAATAUZVSRQIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O2.C22H20F2N6O2.C18H14FN5O.C18H15N5O2/c30-23(16-7-1-4-10-20(16)31-14-13-29-11-5-6-12-29)27-19-15-24-28-21(19)22-25-17-8-2-3-9-18(17)26-22;23-14-2-1-3-15(24)19(14)22(31)28-18-11-25-29-20(18)21-26-16-5-4-13(10-17(16)27-21)12-30-6-8-32-9-7-30;1-10-5-4-6-11(15(10)19)18(25)23-14-9-20-24-16(14)17-21-12-7-2-3-8-13(12)22-17;1-25-12-6-4-5-11(9-12)18(24)22-15-10-19-23-16(15)17-20-13-7-2-3-8-14(13)21-17/h1-4,7-10,15H,5-6,11-14H2,(H,24,28)(H,25,26)(H,27,30);1-5,10-11H,6-9,12H2,(H,25,29)(H,26,27)(H,28,31);2-9H,1H3,(H,20,24)(H,21,22)(H,23,25);2-10H,1H3,(H,19,23)(H,20,21)(H,22,24).
What are the key properties of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide?
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide has a molecular weight of 1523.62 g/mol, XLogP of 13.86, 19 rotatable bonds, 12 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide is sourced from PubChem (CID 158797257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).