N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide

C19H20F3N5O2 — CID 90118944

IUPACN-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
SMILESCc1cc(Cn2cc3c(C(=O)NCCO)nccc3n2)cnc1CCC(F)(F)F
InChIInChI=1S/C19H20F3N5O2/c1-12-8-13(9-25-15(12)2-4-19(20,21)22)10-27-11-14-16(26-27)3-5-23-17(14)18(29)24-6-7-28/h3,5,8-9,11,28H,2,4,6-7,10H2,1H3,(H,24,29)
InChIKeyDXIYQXKFPKRYNT-UHFFFAOYSA-N
MW407.40 g/mol
LogP2.40
Rot. Bonds7

About N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide

N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide (PubChem CID 90118944) has the molecular formula C19H20F3N5O2 and a molecular weight of 407.40 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
PubChem CID90118944
Molecular FormulaC19H20F3N5O2
Molecular Weight407.40 g/mol
Exact Mass407.16
IUPAC NameN-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
SMILESCc1cc(Cn2cc3c(C(=O)NCCO)nccc3n2)cnc1CCC(F)(F)F
InChIInChI=1S/C19H20F3N5O2/c1-12-8-13(9-25-15(12)2-4-19(20,21)22)10-27-11-14-16(26-27)3-5-23-17(14)18(29)24-6-7-28/h3,5,8-9,11,28H,2,4,6-7,10H2,1H3,(H,24,29)
InChIKeyDXIYQXKFPKRYNT-UHFFFAOYSA-N
XLogP2.40
TPSA92.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.40
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropoxy)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
CID 90118652
N-ethyl-2-[[5-methyl-6-(3,3,3-trifluoropropoxy)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
CID 90118891
2-[[5-methyl-6-(3,3,3-trifluoropropoxy)-3-pyridinyl]methyl]-N-propan-2-ylpyrazolo[4,3-c]pyridine-4-carboxamide
CID 90119078
N-[2-[(2-hydroxy-2-methylpropanoyl)amino]ethyl]-2-[[5-methyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
CID 90119186
N-[(2R)-2-hydroxypropyl]-2-[[5-methyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
CID 90118556
N-[(2S)-1-hydroxypropan-2-yl]-2-[[5-methyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
CID 90119273
N-[(2R)-1-hydroxypropan-2-yl]-2-[[5-methyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
CID 74539868
N-methyl-2-[[5-methyl-6-[2-(2,2,2-trifluoroethoxy)ethoxy]-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
CID 90119175
2-[[6-(cyclopropylmethoxy)-5-methyl-3-pyridinyl]methyl]-N-(3-hydroxypropyl)pyrazolo[4,3-c]pyridine-4-carboxamide
CID 90119441
2-[[4-(2,2-difluoropropoxy)-3-methylphenyl]methyl]-N-(3-hydroxypropyl)pyrazolo[4,3-c]pyridine-4-carboxamide
CID 90118695
N-(2-acetamidoethyl)-2-[[5-chloro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
CID 90118927
N-(3-hydroxypropyl)-2-[[4-methyl-5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide
CID 90118662

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide (CID 90118944) is N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide is Cc1cc(Cn2cc3c(C(=O)NCCO)nccc3n2)cnc1CCC(F)(F)F.
What is the InChIKey of N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide?
The InChIKey is DXIYQXKFPKRYNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F3N5O2/c1-12-8-13(9-25-15(12)2-4-19(20,21)22)10-27-11-14-16(26-27)3-5-23-17(14)18(29)24-6-7-28/h3,5,8-9,11,28H,2,4,6-7,10H2,1H3,(H,24,29).
What are the key properties of N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide?
N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide has a molecular weight of 407.40 g/mol, XLogP of 2.40, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-[[5-methyl-6-(3,3,3-trifluoropropyl)-3-pyridinyl]methyl]pyrazolo[4,3-c]pyridine-4-carboxamide is sourced from PubChem (CID 90118944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).