4-[(1-methylpyrazol-4-yl)methoxy]piperidine

C10H17N3O — CID 43346271

IUPAC4-[(1-methylpyrazol-4-yl)methoxy]piperidine
SMILESCn1cc(COC2CCNCC2)cn1
InChIInChI=1S/C10H17N3O/c1-13-7-9(6-12-13)8-14-10-2-4-11-5-3-10/h6-7,10-11H,2-5,8H2,1H3
InChIKeyINBDRWVKXJOBHB-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.69
Rot. Bonds3

About 4-[(1-methylpyrazol-4-yl)methoxy]piperidine

4-[(1-methylpyrazol-4-yl)methoxy]piperidine (PubChem CID 43346271) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 4-[(1-methylpyrazol-4-yl)methoxy]piperidine.

Molecular Properties

Compound Name4-[(1-methylpyrazol-4-yl)methoxy]piperidine
PubChem CID43346271
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name4-[(1-methylpyrazol-4-yl)methoxy]piperidine
SMILESCn1cc(COC2CCNCC2)cn1
InChIInChI=1S/C10H17N3O/c1-13-7-9(6-12-13)8-14-10-2-4-11-5-3-10/h6-7,10-11H,2-5,8H2,1H3
InChIKeyINBDRWVKXJOBHB-UHFFFAOYSA-N
XLogP0.69
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(1-methylpyrazol-4-yl)methoxy]piperidine?
The IUPAC name of 4-[(1-methylpyrazol-4-yl)methoxy]piperidine (CID 43346271) is 4-[(1-methylpyrazol-4-yl)methoxy]piperidine.
What is the SMILES notation for 4-[(1-methylpyrazol-4-yl)methoxy]piperidine?
The canonical SMILES for 4-[(1-methylpyrazol-4-yl)methoxy]piperidine is Cn1cc(COC2CCNCC2)cn1.
What is the InChIKey of 4-[(1-methylpyrazol-4-yl)methoxy]piperidine?
The InChIKey is INBDRWVKXJOBHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-13-7-9(6-12-13)8-14-10-2-4-11-5-3-10/h6-7,10-11H,2-5,8H2,1H3.
What are the key properties of 4-[(1-methylpyrazol-4-yl)methoxy]piperidine?
4-[(1-methylpyrazol-4-yl)methoxy]piperidine has a molecular weight of 195.27 g/mol, XLogP of 0.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-methylpyrazol-4-yl)methoxy]piperidine is sourced from PubChem (CID 43346271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).