N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide

C19H18F3N5O2 — CID 90118610

IUPACN-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide
SMILESCc1cc(Cn2cc3c(NC(=O)C4CC4)nccc3n2)ncc1OCC(F)(F)F
InChIInChI=1S/C19H18F3N5O2/c1-11-6-13(24-7-16(11)29-10-19(20,21)22)8-27-9-14-15(26-27)4-5-23-17(14)25-18(28)12-2-3-12/h4-7,9,12H,2-3,8,10H2,1H3,(H,23,25,28)
InChIKeySRYHCHZCAJQGTK-UHFFFAOYSA-N
MW405.38 g/mol
LogP3.47
Rot. Bonds6

About N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide

N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide (PubChem CID 90118610) has the molecular formula C19H18F3N5O2 and a molecular weight of 405.38 g/mol. Its IUPAC name is N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide
PubChem CID90118610
Molecular FormulaC19H18F3N5O2
Molecular Weight405.38 g/mol
Exact Mass405.14
IUPAC NameN-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide
SMILESCc1cc(Cn2cc3c(NC(=O)C4CC4)nccc3n2)ncc1OCC(F)(F)F
InChIInChI=1S/C19H18F3N5O2/c1-11-6-13(24-7-16(11)29-10-19(20,21)22)8-27-9-14-15(26-27)4-5-23-17(14)25-18(28)12-2-3-12/h4-7,9,12H,2-3,8,10H2,1H3,(H,23,25,28)
InChIKeySRYHCHZCAJQGTK-UHFFFAOYSA-N
XLogP3.47
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.38
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-[[5-methyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide
CID 74539473
N-[2-[[5-(2,2-difluoropropoxy)-4-methyl-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]-2-hydroxy-2-methylpropanamide
CID 90119549
N-[2-[[4-(2,2,2-trifluoroethoxy)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide
CID 74539753
2-hydroxy-2-methyl-N-[2-[[4-methyl-5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide
CID 90118734
ethyl 2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxylate
CID 118443040
N-(3-hydroxypropyl)-2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
CID 90118662
2-[[5-(2,2-difluoropropoxy)-4-methyl-2-pyridinyl]methyl]-N-(2-methylpropyl)pyrazolo[4,3-c]pyridin-4-amine
CID 151713873
N-[6-methyl-2-[[5-methyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide
CID 90119234
N-[2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide
CID 90118852
(2S)-N-[2-[[5-methyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]oxolane-2-carboxamide
CID 74538922
2-[[5-(cyclopropylmethoxy)-4-methyl-2-pyridinyl]methyl]-N-(2-methylpropyl)pyrazolo[4,3-c]pyridin-4-amine
CID 150642598
2-methyl-N-[2-[[6-methyl-5-(2,2,2-trifluoroethoxy)pyrazin-2-yl]methyl]pyrazolo[4,3-c]pyridin-4-yl]propanamide
CID 90118874

Frequently Asked Questions

What is the IUPAC name of N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide?
The IUPAC name of N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide (CID 90118610) is N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide is Cc1cc(Cn2cc3c(NC(=O)C4CC4)nccc3n2)ncc1OCC(F)(F)F.
What is the InChIKey of N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide?
The InChIKey is SRYHCHZCAJQGTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F3N5O2/c1-11-6-13(24-7-16(11)29-10-19(20,21)22)8-27-9-14-15(26-27)4-5-23-17(14)25-18(28)12-2-3-12/h4-7,9,12H,2-3,8,10H2,1H3,(H,23,25,28).
What are the key properties of N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide?
N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide has a molecular weight of 405.38 g/mol, XLogP of 3.47, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridin-4-yl]cyclopropanecarboxamide is sourced from PubChem (CID 90118610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).