3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine

C20H23N5O — CID 74233839

IUPAC3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESCOc1ccccc1-n1cc(CN2CCc3[nH]nc(C4CC4)c3C2)cn1
InChIInChI=1S/C20H23N5O/c1-26-19-5-3-2-4-18(19)25-12-14(10-21-25)11-24-9-8-17-16(13-24)20(23-22-17)15-6-7-15/h2-5,10,12,15H,6-9,11,13H2,1H3,(H,22,23)
InChIKeyWGMAJCGCYQELAV-UHFFFAOYSA-N
MW349.44 g/mol
LogP3.04
Rot. Bonds5

About 3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine

3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine (PubChem CID 74233839) has the molecular formula C20H23N5O and a molecular weight of 349.44 g/mol. Its IUPAC name is 3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
PubChem CID74233839
Molecular FormulaC20H23N5O
Molecular Weight349.44 g/mol
Exact Mass349.19
IUPAC Name3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESCOc1ccccc1-n1cc(CN2CCc3[nH]nc(C4CC4)c3C2)cn1
InChIInChI=1S/C20H23N5O/c1-26-19-5-3-2-4-18(19)25-12-14(10-21-25)11-24-9-8-17-16(13-24)20(23-22-17)15-6-7-15/h2-5,10,12,15H,6-9,11,13H2,1H3,(H,22,23)
InChIKeyWGMAJCGCYQELAV-UHFFFAOYSA-N
XLogP3.04
TPSA58.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-4-(1H-1,2,4-triazol-5-yl)piperidine
CID 74230143
8-methoxy-3-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-3-azabicyclo[3.2.1]octane
CID 156609533
(3R)-1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-3-(1H-1,2,4-triazol-5-yl)piperidine
CID 99946181
5-benzyl-3-pyrrolidin-3-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 172908815
3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 74235381
(7S,9aR)-7-ethyl-2-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,3,4,7,8,9a-hexahydropyrazino[1,2-a]pyrazine-6,9-dione
CID 56856127
(5S)-9-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1-oxa-9-azaspiro[5.5]undecan-5-ol
CID 97186663
4-[4-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]piperazin-1-yl]sulfonylmorpholine
CID 131935843
(7S,9aR)-2-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-7-propan-2-yl-1,3,4,7,8,9a-hexahydropyrazino[1,2-a]pyrazine-6,9-dione
CID 56856634
4-[1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]piperidin-3-yl]morpholine
CID 45219237
2-[(2S)-1-cyclopentyl-4-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]piperazin-2-yl]ethanol
CID 28925095
(7S,9aR)-2-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-7,8-dimethyl-3,4,7,9a-tetrahydro-1H-pyrazino[1,2-a]pyrazine-6,9-dione
CID 56852323

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The IUPAC name of 3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine (CID 74233839) is 3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine is COc1ccccc1-n1cc(CN2CCc3[nH]nc(C4CC4)c3C2)cn1.
What is the InChIKey of 3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The InChIKey is WGMAJCGCYQELAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O/c1-26-19-5-3-2-4-18(19)25-12-14(10-21-25)11-24-9-8-17-16(13-24)20(23-22-17)15-6-7-15/h2-5,10,12,15H,6-9,11,13H2,1H3,(H,22,23).
What are the key properties of 3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine?
3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine has a molecular weight of 349.44 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine is sourced from PubChem (CID 74233839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).