cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide

C80H69F8N13O8 — CID 160923017

IUPACcis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide
SMILESO=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)C1(CO)CC1.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)C1(O)CC1.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)[C@@H]1CCC[C@@H]1O.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)[C@@H]1C[C@@H](O)CN1
InChIInChI=1S/C21H19F2N3O2.C20H18F2N4O2.C20H17F2N3O2.C19H15F2N3O2/c22-13-7-4-12(5-8-13)6-9-17-15-10-19(16(23)11-18(15)26-25-17)24-21(28)14-2-1-3-20(14)27;21-12-4-1-11(2-5-12)3-6-16-14-8-18(15(22)9-17(14)26-25-16)24-20(28)19-7-13(27)10-23-19;21-13-4-1-12(2-5-13)3-6-16-14-9-18(15(22)10-17(14)25-24-16)23-19(27)20(11-26)7-8-20;20-12-4-1-11(2-5-12)3-6-15-13-9-17(14(21)10-16(13)24-23-15)22-18(25)19(26)7-8-19/h4-11,14,20,27H,1-3H2,(H,24,28)(H,25,26);1-6,8-9,13,19,23,27H,7,10H2,(H,24,28)(H,25,26);1-6,9-10,26H,7-8,11H2,(H,23,27)(H,24,25);1-6,9-10,26H,7-8H2,(H,22,25)(H,23,24)/b9-6+;3*6-3+/t14-,20+;13-,19+;;/m11../s1
InChIKeySSGVLTGLHFHLQS-HEPIUQMISA-N
MW1492.50 g/mol
LogP13.98
Rot. Bonds17

About cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide

cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide (PubChem CID 160923017) has the molecular formula C80H69F8N13O8 and a molecular weight of 1492.50 g/mol. Its IUPAC name is cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide.

Molecular Properties

Compound Namecis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide
PubChem CID160923017
Molecular FormulaC80H69F8N13O8
Molecular Weight1492.50 g/mol
Exact Mass1491.53
IUPAC Namecis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide
SMILESO=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)C1(CO)CC1.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)C1(O)CC1.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)[C@@H]1CCC[C@@H]1O.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)[C@@H]1C[C@@H](O)CN1
InChIInChI=1S/C21H19F2N3O2.C20H18F2N4O2.C20H17F2N3O2.C19H15F2N3O2/c22-13-7-4-12(5-8-13)6-9-17-15-10-19(16(23)11-18(15)26-25-17)24-21(28)14-2-1-3-20(14)27;21-12-4-1-11(2-5-12)3-6-16-14-8-18(15(22)9-17(14)26-25-16)24-20(28)19-7-13(27)10-23-19;21-13-4-1-12(2-5-13)3-6-16-14-9-18(15(22)10-17(14)25-24-16)23-19(27)20(11-26)7-8-20;20-12-4-1-11(2-5-12)3-6-15-13-9-17(14(21)10-16(13)24-23-15)22-18(25)19(26)7-8-19/h4-11,14,20,27H,1-3H2,(H,24,28)(H,25,26);1-6,8-9,13,19,23,27H,7,10H2,(H,24,28)(H,25,26);1-6,9-10,26H,7-8,11H2,(H,23,27)(H,24,25);1-6,9-10,26H,7-8H2,(H,22,25)(H,23,24)/b9-6+;3*6-3+/t14-,20+;13-,19+;;/m11../s1
InChIKeySSGVLTGLHFHLQS-HEPIUQMISA-N
XLogP13.98
TPSA324.07 Ų
H-Bond Donors13
H-Bond Acceptors13
Rotatable Bonds17
Heavy Atoms109
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001492.50
LogP ≤ 513.98
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1013

Analyze cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide?
The IUPAC name of cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide (CID 160923017) is cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide.
What is the SMILES notation for cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide?
The canonical SMILES for cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide is O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)C1(CO)CC1.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)C1(O)CC1.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)[C@@H]1CCC[C@@H]1O.O=C(Nc1cc2c(/C=C/c3ccc(F)cc3)n[nH]c2cc1F)[C@@H]1C[C@@H](O)CN1.
What is the InChIKey of cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide?
The InChIKey is SSGVLTGLHFHLQS-HEPIUQMISA-N. The full InChI is InChI=1S/C21H19F2N3O2.C20H18F2N4O2.C20H17F2N3O2.C19H15F2N3O2/c22-13-7-4-12(5-8-13)6-9-17-15-10-19(16(23)11-18(15)26-25-17)24-21(28)14-2-1-3-20(14)27;21-12-4-1-11(2-5-12)3-6-16-14-8-18(15(22)9-17(14)26-25-16)24-20(28)19-7-13(27)10-23-19;21-13-4-1-12(2-5-13)3-6-16-14-9-18(15(22)10-17(14)25-24-16)23-19(27)20(11-26)7-8-20;20-12-4-1-11(2-5-12)3-6-15-13-9-17(14(21)10-16(13)24-23-15)22-18(25)19(26)7-8-19/h4-11,14,20,27H,1-3H2,(H,24,28)(H,25,26);1-6,8-9,13,19,23,27H,7,10H2,(H,24,28)(H,25,26);1-6,9-10,26H,7-8,11H2,(H,23,27)(H,24,25);1-6,9-10,26H,7-8H2,(H,22,25)(H,23,24)/b9-6+;3*6-3+/t14-,20+;13-,19+;;/m11../s1.
What are the key properties of cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide?
cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide has a molecular weight of 1492.50 g/mol, XLogP of 13.98, 17 rotatable bonds, 13 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-2-hydroxycyclopentane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-hydroxycyclopropane-1-carboxamide;N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-1-(hydroxymethyl)cyclopropane-1-carboxamide;(2S,4R)-N-[6-fluoro-3-[(E)-2-(4-fluorophenyl)ethenyl]-1H-indazol-5-yl]-4-hydroxypyrrolidine-2-carboxamide is sourced from PubChem (CID 160923017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).