2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine

C14H16N2O — CID 71814126

IUPAC2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
SMILESc1ccc(COc2cc3n(n2)CCCC3)cc1
InChIInChI=1S/C14H16N2O/c1-2-6-12(7-3-1)11-17-14-10-13-8-4-5-9-16(13)15-14/h1-3,6-7,10H,4-5,8-9,11H2
InChIKeyFOMWLSGCCPABID-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.80
Rot. Bonds3

About 2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine

2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine (PubChem CID 71814126) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
PubChem CID71814126
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
SMILESc1ccc(COc2cc3n(n2)CCCC3)cc1
InChIInChI=1S/C14H16N2O/c1-2-6-12(7-3-1)11-17-14-10-13-8-4-5-9-16(13)15-14/h1-3,6-7,10H,4-5,8-9,11H2
InChIKeyFOMWLSGCCPABID-UHFFFAOYSA-N
XLogP2.80
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The IUPAC name of 2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine (CID 71814126) is 2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine.
What is the SMILES notation for 2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The canonical SMILES for 2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine is c1ccc(COc2cc3n(n2)CCCC3)cc1.
What is the InChIKey of 2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The InChIKey is FOMWLSGCCPABID-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-2-6-12(7-3-1)11-17-14-10-13-8-4-5-9-16(13)15-14/h1-3,6-7,10H,4-5,8-9,11H2.
What are the key properties of 2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine has a molecular weight of 228.30 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylmethoxy-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine is sourced from PubChem (CID 71814126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).