5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol

C16H20N2O2 — CID 118706768

IUPAC5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol
SMILESCC1(C)CCn2nc(COc3ccccc3)cc2C1O
InChIInChI=1S/C16H20N2O2/c1-16(2)8-9-18-14(15(16)19)10-12(17-18)11-20-13-6-4-3-5-7-13/h3-7,10,15,19H,8-9,11H2,1-2H3
InChIKeyJMNBTPRXPPRKRR-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.93
Rot. Bonds3

About 5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol

5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol (PubChem CID 118706768) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol.

Molecular Properties

Compound Name5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol
PubChem CID118706768
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol
SMILESCC1(C)CCn2nc(COc3ccccc3)cc2C1O
InChIInChI=1S/C16H20N2O2/c1-16(2)8-9-18-14(15(16)19)10-12(17-18)11-20-13-6-4-3-5-7-13/h3-7,10,15,19H,8-9,11H2,1-2H3
InChIKeyJMNBTPRXPPRKRR-UHFFFAOYSA-N
XLogP2.93
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol with MolForge

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Related Compounds

5,5-Dimethyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyridin-4-one
CID 118706757
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
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
1-(4-Tert-butylphenoxy)-3-(3,5-dimethylpyrazol-1-yl)propan-2-ol
CID 18560731
[1-[(1-isopropyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-(4-methoxybenzyl)piperidin-4-yl]methanol
CID 16191760
2-[3-(3,5-Dimethylpyrazol-1-yl)azetidin-1-yl]-1-(4-methoxyphenyl)ethanol
CID 56781730
4-Methoxy-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 118706762
4-(Cyclopropylmethoxy)-2-(phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 118706764
5,5-dimethyl-2-(phenoxymethyl)-4-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyridine
CID 118706766
2-(Phenoxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol
CID 118706767

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol?
The IUPAC name of 5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol (CID 118706768) is 5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol.
What is the SMILES notation for 5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol?
The canonical SMILES for 5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol is CC1(C)CCn2nc(COc3ccccc3)cc2C1O.
What is the InChIKey of 5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol?
The InChIKey is JMNBTPRXPPRKRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-16(2)8-9-18-14(15(16)19)10-12(17-18)11-20-13-6-4-3-5-7-13/h3-7,10,15,19H,8-9,11H2,1-2H3.
What are the key properties of 5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol?
5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol has a molecular weight of 272.35 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-2-(phenoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyridin-4-ol is sourced from PubChem (CID 118706768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).