[4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol

C14H25N3O — CID 66025190

IUPAC[4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol
SMILESCCc1cc(CC2(CO)CCNCC2)n(CC)n1
InChIInChI=1S/C14H25N3O/c1-3-12-9-13(17(4-2)16-12)10-14(11-18)5-7-15-8-6-14/h9,15,18H,3-8,10-11H2,1-2H3
InChIKeyOPNYIQSVXBFIRF-UHFFFAOYSA-N
MW251.37 g/mol
LogP1.37
Rot. Bonds5

About [4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol

[4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol (PubChem CID 66025190) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is [4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol.

Molecular Properties

Compound Name[4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol
PubChem CID66025190
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name[4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol
SMILESCCc1cc(CC2(CO)CCNCC2)n(CC)n1
InChIInChI=1S/C14H25N3O/c1-3-12-9-13(17(4-2)16-12)10-14(11-18)5-7-15-8-6-14/h9,15,18H,3-8,10-11H2,1-2H3
InChIKeyOPNYIQSVXBFIRF-UHFFFAOYSA-N
XLogP1.37
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol?
The IUPAC name of [4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol (CID 66025190) is [4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol.
What is the SMILES notation for [4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol?
The canonical SMILES for [4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol is CCc1cc(CC2(CO)CCNCC2)n(CC)n1.
What is the InChIKey of [4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol?
The InChIKey is OPNYIQSVXBFIRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-3-12-9-13(17(4-2)16-12)10-14(11-18)5-7-15-8-6-14/h9,15,18H,3-8,10-11H2,1-2H3.
What are the key properties of [4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol?
[4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol has a molecular weight of 251.37 g/mol, XLogP of 1.37, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(1,3-diethylpyrazol-5-yl)methyl]piperidin-4-yl]methanol is sourced from PubChem (CID 66025190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).