2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine

C11H19N3O — CID 131382411

IUPAC2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine
SMILESCOc1c(C2CCCCN2)c(C)nn1C
InChIInChI=1S/C11H19N3O/c1-8-10(9-6-4-5-7-12-9)11(15-3)14(2)13-8/h9,12H,4-7H2,1-3H3
InChIKeyMBDYMPBWXSVVJX-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.55
Rot. Bonds2

About 2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine

2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine (PubChem CID 131382411) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine.

Molecular Properties

Compound Name2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine
PubChem CID131382411
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine
SMILESCOc1c(C2CCCCN2)c(C)nn1C
InChIInChI=1S/C11H19N3O/c1-8-10(9-6-4-5-7-12-9)11(15-3)14(2)13-8/h9,12H,4-7H2,1-3H3
InChIKeyMBDYMPBWXSVVJX-UHFFFAOYSA-N
XLogP1.55
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,3,5-trimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole
CID 95566954
5-chloro-1,3-dimethyl-4-[(2S)-pyrrolidin-2-yl]pyrazole
CID 95970426
1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole
CID 99978633
2-chloro-4,6-dimethyl-5-piperidin-2-ylpyrimidine
CID 115070130
2-(4-methoxy-1-methylpyrazol-5-yl)piperidine
CID 114663133
2-(2,5-dimethyl-1,2,4-triazol-3-yl)azepane
CID 64562693
1,3-dimethyl-5-[(2R)-pyrrolidin-2-yl]pyrazole
CID 42575745
2-[3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazol-1-yl]acetic acid
CID 99978642
2-(3-bromo-4-methoxy-2,5,6-trimethylphenyl)piperidine
CID 117116349
5-methoxy-1-methyl-3-piperidin-2-ylindazole
CID 82622650
2-(3-ethyl-1-methylpyrazol-5-yl)azepane
CID 81146779
2-methoxy-3-methyl-6-piperidin-2-ylpyridine
CID 84674495

Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine?
The IUPAC name of 2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine (CID 131382411) is 2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine.
What is the SMILES notation for 2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine?
The canonical SMILES for 2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine is COc1c(C2CCCCN2)c(C)nn1C.
What is the InChIKey of 2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine?
The InChIKey is MBDYMPBWXSVVJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-8-10(9-6-4-5-7-12-9)11(15-3)14(2)13-8/h9,12H,4-7H2,1-3H3.
What are the key properties of 2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine?
2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine has a molecular weight of 209.29 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxy-1,3-dimethylpyrazol-4-yl)piperidine is sourced from PubChem (CID 131382411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).