About (1S)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1R)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1S)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide;N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide
(1S)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1R)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1S)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide;N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide (PubChem CID 158892953) has the molecular formula C100H107F8N25O10
and a molecular weight of 1971.10 g/mol. Its IUPAC name is (1S)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1R)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1S)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide;N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide.
Frequently Asked Questions
What is the IUPAC name of (1S)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1R)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1S)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide;N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide?
The IUPAC name of (1S)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1R)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1S)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide;N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide (CID 158892953) is (1S)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1R)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1S)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide;N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide.
What is the SMILES notation for (1S)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1R)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1S)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide;N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide?
The canonical SMILES for (1S)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1R)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1S)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide;N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide is O=C(Nc1nc2cccc(C3=CC[C@@H](NC(=O)C4CC4F)CC3)n2n1)C1CC1.O=C(Nc1nc2cccc(C3=CC[C@@H](NC(=O)[C@@H]4CC4(F)F)CC3)n2n1)C1CC1.O=C(Nc1nc2cccc(C3=CC[C@@H](NC(=O)[C@H]4CC4(F)F)CC3)n2n1)C1CC1.O=C(Nc1nc2cccc(C3=CC[C@H](NC(=O)C4CC4F)CC3)n2n1)C1CC1.O=C(Nc1nc2cccc(C3=CC[C@H](NC(=O)[C@@H]4CC4(F)F)CC3)n2n1)C1CC1.
What is the InChIKey of (1S)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1R)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1S)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide;N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide?
The InChIKey is JELTXIOUEBOJGC-ZWVDNQHESA-N. The full InChI is InChI=1S/3C20H21F2N5O2.2C20H22FN5O2/c3*21-20(22)10-14(20)18(29)23-13-8-6-11(7-9-13)15-2-1-3-16-24-19(26-27(15)16)25-17(28)12-4-5-12;2*21-15-10-14(15)19(28)22-13-8-6-11(7-9-13)16-2-1-3-17-23-20(25-26(16)17)24-18(27)12-4-5-12/h3*1-3,6,12-14H,4-5,7-10H2,(H,23,29)(H,25,26,28);2*1-3,6,12-15H,4-5,7-10H2,(H,22,28)(H,24,25,27)/t13-,14+;2*13-,14-;2*13-,14?,15?/m11010/s1.
What are the key properties of (1S)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1R)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1S)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide;N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide?
(1S)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1R)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1S)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide;N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide has a molecular weight of 1971.10 g/mol, XLogP of 13.33, 25 rotatable bonds, 10 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1R)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;(1S)-N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2,2-difluorocyclopropane-1-carboxamide;N-[(1R)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide;N-[(1S)-4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]cyclohex-3-en-1-yl]-2-fluorocyclopropane-1-carboxamide is sourced from PubChem (CID 158892953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).