3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine

C11H19N3O — CID 62340735

IUPAC3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine
SMILESCn1cc(COCC2CCCNC2)cn1
InChIInChI=1S/C11H19N3O/c1-14-7-11(6-13-14)9-15-8-10-3-2-4-12-5-10/h6-7,10,12H,2-5,8-9H2,1H3
InChIKeyYAHQMYYZCSEMLK-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.94
Rot. Bonds4

About 3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine

3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine (PubChem CID 62340735) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine.

Molecular Properties

Compound Name3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine
PubChem CID62340735
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine
SMILESCn1cc(COCC2CCCNC2)cn1
InChIInChI=1S/C11H19N3O/c1-14-7-11(6-13-14)9-15-8-10-3-2-4-12-5-10/h6-7,10,12H,2-5,8-9H2,1H3
InChIKeyYAHQMYYZCSEMLK-UHFFFAOYSA-N
XLogP0.94
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-4-(pyrrolidin-3-ylmethoxymethyl)pyrazole
CID 62371587
4-[[(3S)-piperidin-3-yl]methoxymethyl]pyridine
CID 94403087
(3R)-3-[(4-methylphenyl)methoxymethyl]piperidine
CID 26190607
1-methyl-N-[[(3S)-piperidin-3-yl]methyl]pyrazol-4-amine
CID 130523385
(3R)-3-[(4-bromophenyl)methoxymethyl]piperidine
CID 35754092
3-[(4-propan-2-ylphenyl)methoxymethyl]piperidine
CID 55060808
1-(1-methylpyrazol-4-yl)-2-piperidin-3-ylethanone
CID 116564116
3-methoxy-6-(piperidin-3-ylmethoxymethyl)pyridazine
CID 114268734
N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-3-amine
CID 63636731
4-(piperidin-3-ylmethoxymethyl)pyridine-2-carbonitrile
CID 63880785
(3S)-3-(ethoxymethyl)piperidine
CID 42427180
(3R)-3-(ethoxymethyl)piperidine
CID 42427178

Frequently Asked Questions

What is the IUPAC name of 3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine?
The IUPAC name of 3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine (CID 62340735) is 3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine.
What is the SMILES notation for 3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine?
The canonical SMILES for 3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine is Cn1cc(COCC2CCCNC2)cn1.
What is the InChIKey of 3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine?
The InChIKey is YAHQMYYZCSEMLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-14-7-11(6-13-14)9-15-8-10-3-2-4-12-5-10/h6-7,10,12H,2-5,8-9H2,1H3.
What are the key properties of 3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine?
3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine has a molecular weight of 209.29 g/mol, XLogP of 0.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-methylpyrazol-4-yl)methoxymethyl]piperidine is sourced from PubChem (CID 62340735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).