4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine

C15H18N2O2 — CID 118706762

IUPAC4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
SMILESCOC1CCCn2nc(COc3ccccc3)cc21
InChIInChI=1S/C15H18N2O2/c1-18-15-8-5-9-17-14(15)10-12(16-17)11-19-13-6-3-2-4-7-13/h2-4,6-7,10,15H,5,8-9,11H2,1H3
InChIKeyICSSNRVOONIPGW-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.94
Rot. Bonds4

About 4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine

4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine (PubChem CID 118706762) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
PubChem CID118706762
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
SMILESCOC1CCCn2nc(COc3ccccc3)cc21
InChIInChI=1S/C15H18N2O2/c1-18-15-8-5-9-17-14(15)10-12(16-17)11-19-13-6-3-2-4-7-13/h2-4,6-7,10,15H,5,8-9,11H2,1H3
InChIKeyICSSNRVOONIPGW-UHFFFAOYSA-N
XLogP2.94
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3,5-Dimethyl-pyrazol-1-yl)-3-phenoxy-propan-2-ol
CID 3127806
2-[4-(2,5-Difluorophenoxy)-3,5-diethyl-pyrazol-1-yl]ethanol
CID 9922209
2-(phenoxymethyl)-6,7-dihydropyrazolo(1,5-a)pyridin-4(5H)-one
CID 70660712
2-[(3-Methylphenyl)methoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 71814128
4-methoxy-5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridine
CID 118706763
2-(Phenoxymethyl)-4-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 118706765
2-(Phenoxymethyl)-4-(4-propan-2-ylpiperazin-1-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 118706776
2-(phenoxymethyl)-N-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-amine
CID 118706777
N-benzyl-N-methyl-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-amine
CID 118706780
4,4-difluoro-2-(phenoxymethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyridine
CID 118706957
4-[2-[1-(4-Methoxyphenyl)-5-methylpyrazol-3-yl]oxyethyl]morpholine
CID 11544226
2-[3,5-Diethyl-4-(2-fluorophenoxy)pyrazol-1-yl]ethanol
CID 9814217

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The IUPAC name of 4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine (CID 118706762) is 4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine.
What is the SMILES notation for 4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The canonical SMILES for 4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine is COC1CCCn2nc(COc3ccccc3)cc21.
What is the InChIKey of 4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The InChIKey is ICSSNRVOONIPGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-18-15-8-5-9-17-14(15)10-12(16-17)11-19-13-6-3-2-4-7-13/h2-4,6-7,10,15H,5,8-9,11H2,1H3.
What are the key properties of 4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine has a molecular weight of 258.32 g/mol, XLogP of 2.94, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine is sourced from PubChem (CID 118706762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).