2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C84H79Cl5F3N35O10 — CID 161383028

IUPAC2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCN(C)CCOc1cc(C(F)(F)F)ncc1NC(=O)c1c(N)nn2cc(Cl)cnc12.CN1CC[C@H](Oc2ccncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)C1.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CC2(CNC2)C1.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CNC1.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1Oc1cccnc1
InChIInChI=1S/C18H18ClN7O2.C17H17ClF3N7O2.C17H18ClN7O2.C17H12ClN7O2.C15H14ClN7O2/c19-10-5-23-16-14(15(20)25-26(16)7-10)17(27)24-12-6-21-2-1-13(12)28-11-3-18(4-11)8-22-9-18;1-27(2)3-4-30-11-5-12(17(19,20)21)23-7-10(11)25-16(29)13-14(22)26-28-8-9(18)6-24-15(13)28;1-24-5-3-11(9-24)27-13-2-4-20-7-12(13)22-17(26)14-15(19)23-25-8-10(18)6-21-16(14)25;18-10-6-22-16-14(15(19)24-25(16)9-10)17(26)23-12-8-21-5-3-13(12)27-11-2-1-4-20-7-11;16-8-3-20-14-12(13(17)22-23(14)7-8)15(24)21-10-6-18-2-1-11(10)25-9-4-19-5-9/h1-2,5-7,11,22H,3-4,8-9H2,(H2,20,25)(H,24,27);5-8H,3-4H2,1-2H3,(H2,22,26)(H,25,29);2,4,6-8,11H,3,5,9H2,1H3,(H2,19,23)(H,22,26);1-9H,(H2,19,24)(H,23,26);1-3,6-7,9,19H,4-5H2,(H2,17,22)(H,21,24)/t;;11-;;/m..0../s1
InChIKeyVRYWKOTVCZDRHO-MUUDHUNJSA-N
MW1973.05 g/mol
LogP9.77
Rot. Bonds22

About 2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 161383028) has the molecular formula C84H79Cl5F3N35O10 and a molecular weight of 1973.05 g/mol. Its IUPAC name is 2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID161383028
Molecular FormulaC84H79Cl5F3N35O10
Molecular Weight1973.05 g/mol
Exact Mass1969.51
IUPAC Name2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCN(C)CCOc1cc(C(F)(F)F)ncc1NC(=O)c1c(N)nn2cc(Cl)cnc12.CN1CC[C@H](Oc2ccncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)C1.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CC2(CNC2)C1.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CNC1.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1Oc1cccnc1
InChIInChI=1S/C18H18ClN7O2.C17H17ClF3N7O2.C17H18ClN7O2.C17H12ClN7O2.C15H14ClN7O2/c19-10-5-23-16-14(15(20)25-26(16)7-10)17(27)24-12-6-21-2-1-13(12)28-11-3-18(4-11)8-22-9-18;1-27(2)3-4-30-11-5-12(17(19,20)21)23-7-10(11)25-16(29)13-14(22)26-28-8-9(18)6-24-15(13)28;1-24-5-3-11(9-24)27-13-2-4-20-7-12(13)22-17(26)14-15(19)23-25-8-10(18)6-21-16(14)25;18-10-6-22-16-14(15(19)24-25(16)9-10)17(26)23-12-8-21-5-3-13(12)27-11-2-1-4-20-7-11;16-8-3-20-14-12(13(17)22-23(14)7-8)15(24)21-10-6-18-2-1-11(10)25-9-4-19-5-9/h1-2,5-7,11,22H,3-4,8-9H2,(H2,20,25)(H,24,27);5-8H,3-4H2,1-2H3,(H2,22,26)(H,25,29);2,4,6-8,11H,3,5,9H2,1H3,(H2,19,23)(H,22,26);1-9H,(H2,19,24)(H,23,26);1-3,6-7,9,19H,4-5H2,(H2,17,22)(H,21,24)/t;;11-;;/m..0../s1
InChIKeyVRYWKOTVCZDRHO-MUUDHUNJSA-N
XLogP9.77
TPSA580.58 Ų
H-Bond Donors12
H-Bond Acceptors40
Rotatable Bonds22
Heavy Atoms137
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001973.05
LogP ≤ 59.77
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1040

Analyze 2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 161383028) is 2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is CN(C)CCOc1cc(C(F)(F)F)ncc1NC(=O)c1c(N)nn2cc(Cl)cnc12.CN1CC[C@H](Oc2ccncc2NC(=O)c2c(N)nn3cc(Cl)cnc23)C1.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CC2(CNC2)C1.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1OC1CNC1.Nc1nn2cc(Cl)cnc2c1C(=O)Nc1cnccc1Oc1cccnc1.
What is the InChIKey of 2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is VRYWKOTVCZDRHO-MUUDHUNJSA-N. The full InChI is InChI=1S/C18H18ClN7O2.C17H17ClF3N7O2.C17H18ClN7O2.C17H12ClN7O2.C15H14ClN7O2/c19-10-5-23-16-14(15(20)25-26(16)7-10)17(27)24-12-6-21-2-1-13(12)28-11-3-18(4-11)8-22-9-18;1-27(2)3-4-30-11-5-12(17(19,20)21)23-7-10(11)25-16(29)13-14(22)26-28-8-9(18)6-24-15(13)28;1-24-5-3-11(9-24)27-13-2-4-20-7-12(13)22-17(26)14-15(19)23-25-8-10(18)6-21-16(14)25;18-10-6-22-16-14(15(19)24-25(16)9-10)17(26)23-12-8-21-5-3-13(12)27-11-2-1-4-20-7-11;16-8-3-20-14-12(13(17)22-23(14)7-8)15(24)21-10-6-18-2-1-11(10)25-9-4-19-5-9/h1-2,5-7,11,22H,3-4,8-9H2,(H2,20,25)(H,24,27);5-8H,3-4H2,1-2H3,(H2,22,26)(H,25,29);2,4,6-8,11H,3,5,9H2,1H3,(H2,19,23)(H,22,26);1-9H,(H2,19,24)(H,23,26);1-3,6-7,9,19H,4-5H2,(H2,17,22)(H,21,24)/t;;11-;;/m..0../s1.
What are the key properties of 2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 1973.05 g/mol, XLogP of 9.77, 22 rotatable bonds, 12 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(2-azaspiro[3.3]heptan-6-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(azetidin-3-yloxy)-3-pyridinyl]-6-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[2-(dimethylamino)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-[4-[(3S)-1-methylpyrrolidin-3-yl]oxy-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-chloro-N-(4-pyridin-3-yloxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 161383028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).