N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide

C37H30F6N10O2 — CID 89049271

IUPACN-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide
SMILESCc1ncccc1C(=O)Nc1ccc(-n2nc(C(F)(F)F)cc2C2CC2)nc1.O=C(Nc1ccc(-n2nc(C(F)(F)F)cc2C2CC2)nc1)c1cccnc1
InChIInChI=1S/C19H16F3N5O.C18H14F3N5O/c1-11-14(3-2-8-23-11)18(28)25-13-6-7-17(24-10-13)27-15(12-4-5-12)9-16(26-27)19(20,21)22;19-18(20,21)15-8-14(11-3-4-11)26(25-15)16-6-5-13(10-23-16)24-17(27)12-2-1-7-22-9-12/h2-3,6-10,12H,4-5H2,1H3,(H,25,28);1-2,5-11H,3-4H2,(H,24,27)
InChIKeyRZJQQAGDJKZUGA-UHFFFAOYSA-N
MW760.70 g/mol
LogP7.93
Rot. Bonds8

About N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide

N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide (PubChem CID 89049271) has the molecular formula C37H30F6N10O2 and a molecular weight of 760.70 g/mol. Its IUPAC name is N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide
PubChem CID89049271
Molecular FormulaC37H30F6N10O2
Molecular Weight760.70 g/mol
Exact Mass760.25
IUPAC NameN-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide
SMILESCc1ncccc1C(=O)Nc1ccc(-n2nc(C(F)(F)F)cc2C2CC2)nc1.O=C(Nc1ccc(-n2nc(C(F)(F)F)cc2C2CC2)nc1)c1cccnc1
InChIInChI=1S/C19H16F3N5O.C18H14F3N5O/c1-11-14(3-2-8-23-11)18(28)25-13-6-7-17(24-10-13)27-15(12-4-5-12)9-16(26-27)19(20,21)22;19-18(20,21)15-8-14(11-3-4-11)26(25-15)16-6-5-13(10-23-16)24-17(27)12-2-1-7-22-9-12/h2-3,6-10,12H,4-5H2,1H3,(H,25,28);1-2,5-11H,3-4H2,(H,24,27)
InChIKeyRZJQQAGDJKZUGA-UHFFFAOYSA-N
XLogP7.93
TPSA145.40 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500760.70
LogP ≤ 57.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide (CID 89049271) is N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide is Cc1ncccc1C(=O)Nc1ccc(-n2nc(C(F)(F)F)cc2C2CC2)nc1.O=C(Nc1ccc(-n2nc(C(F)(F)F)cc2C2CC2)nc1)c1cccnc1.
What is the InChIKey of N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide?
The InChIKey is RZJQQAGDJKZUGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F3N5O.C18H14F3N5O/c1-11-14(3-2-8-23-11)18(28)25-13-6-7-17(24-10-13)27-15(12-4-5-12)9-16(26-27)19(20,21)22;19-18(20,21)15-8-14(11-3-4-11)26(25-15)16-6-5-13(10-23-16)24-17(27)12-2-1-7-22-9-12/h2-3,6-10,12H,4-5H2,1H3,(H,25,28);1-2,5-11H,3-4H2,(H,24,27).
What are the key properties of N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide?
N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide has a molecular weight of 760.70 g/mol, XLogP of 7.93, 8 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-2-methylpyridine-3-carboxamide;N-[6-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 89049271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).