3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine

C15H19N3O — CID 82380463

IUPAC3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine
SMILESCOc1ccc(-c2cn[nH]c2C2CCCNC2)cc1
InChIInChI=1S/C15H19N3O/c1-19-13-6-4-11(5-7-13)14-10-17-18-15(14)12-3-2-8-16-9-12/h4-7,10,12,16H,2-3,8-9H2,1H3,(H,17,18)
InChIKeyVZYRFSOPLFJCFL-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.55
Rot. Bonds3

About 3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine

3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine (PubChem CID 82380463) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine.

Molecular Properties

Compound Name3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine
PubChem CID82380463
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine
SMILESCOc1ccc(-c2cn[nH]c2C2CCCNC2)cc1
InChIInChI=1S/C15H19N3O/c1-19-13-6-4-11(5-7-13)14-10-17-18-15(14)12-3-2-8-16-9-12/h4-7,10,12,16H,2-3,8-9H2,1H3,(H,17,18)
InChIKeyVZYRFSOPLFJCFL-UHFFFAOYSA-N
XLogP2.55
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-[4-[4-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]piperidine
CID 95839881
4-(4-methoxyphenyl)-5-piperidin-3-yl-1,2-oxazole
CID 115003500
5-(4-methoxyphenyl)-4-piperidin-3-ylpyrimidin-2-amine
CID 110246159
3-(4-methoxyphenyl)piperidine
CID 12937920
(3S)-3-[4-(3-chlorophenyl)-1H-pyrazol-5-yl]piperidine
CID 124858934
(3R)-3-[4-(2,6-difluorophenyl)-1H-pyrazol-5-yl]piperidine
CID 125171992
2-(4-methoxyphenyl)-4-piperidin-3-ylpyridine;hydrochloride
CID 118741830
(3S)-3-[1-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]triazol-4-yl]piperidine
CID 97206014
(3S)-3-(4-methylsulfonyl-1H-pyrazol-5-yl)piperidine
CID 92614938
(3S)-3-(4-propan-2-yl-1H-pyrazol-5-yl)piperidine
CID 96623523
(3S)-1-[(2-fluoro-5-methoxyphenyl)methyl]-3-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidine
CID 26401758
(3S)-1-[(2-fluoro-4-methoxyphenyl)methyl]-3-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidine
CID 42479392

Frequently Asked Questions

What is the IUPAC name of 3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine?
The IUPAC name of 3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine (CID 82380463) is 3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine.
What is the SMILES notation for 3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine?
The canonical SMILES for 3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine is COc1ccc(-c2cn[nH]c2C2CCCNC2)cc1.
What is the InChIKey of 3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine?
The InChIKey is VZYRFSOPLFJCFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-19-13-6-4-11(5-7-13)14-10-17-18-15(14)12-3-2-8-16-9-12/h4-7,10,12,16H,2-3,8-9H2,1H3,(H,17,18).
What are the key properties of 3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine?
3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine has a molecular weight of 257.34 g/mol, XLogP of 2.55, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine is sourced from PubChem (CID 82380463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).