4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine

C14H25N3O — CID 114272278

IUPAC4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine
SMILESCOc1cnn(C(C)C)c1C1CC(C)NC(C)C1
InChIInChI=1S/C14H25N3O/c1-9(2)17-14(13(18-5)8-15-17)12-6-10(3)16-11(4)7-12/h8-12,16H,6-7H2,1-5H3
InChIKeyFWPKDDUEWTYECC-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.72
Rot. Bonds3

About 4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine

4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine (PubChem CID 114272278) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine.

Molecular Properties

Compound Name4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine
PubChem CID114272278
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine
SMILESCOc1cnn(C(C)C)c1C1CC(C)NC(C)C1
InChIInChI=1S/C14H25N3O/c1-9(2)17-14(13(18-5)8-15-17)12-6-10(3)16-11(4)7-12/h8-12,16H,6-7H2,1-5H3
InChIKeyFWPKDDUEWTYECC-UHFFFAOYSA-N
XLogP2.72
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylcycloheptan-1-amine
CID 114664209
4-methoxy-5-methyl-1-propan-2-ylpyrazole
CID 149332345
N-[[2-(4-methoxy-1-propan-2-ylpyrazol-5-yl)cyclohexyl]methyl]propan-2-amine
CID 114667230
N-[[2-(4-methoxy-1-propan-2-ylpyrazol-5-yl)cyclopentyl]methyl]ethanamine
CID 114667107
N-[[2-(4-methoxy-1-propan-2-ylpyrazol-5-yl)cyclopentyl]methyl]-2-methylpropan-1-amine
CID 114667176
5-(3-bromocyclopentyl)-4-chloro-1-propan-2-ylpyrazole
CID 114665383
1-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanol
CID 114633612
2-ethyl-2-methoxy-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)butan-1-ol
CID 114645769
2-cyclopropyl-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propan-1-ol
CID 115837387
2,2-diethoxy-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethanone
CID 114641410
N-[(4-methoxy-1-propan-2-ylpyrazol-5-yl)methyl]ethanamine
CID 114652068
5-(3-bromo-1-methylcyclopentyl)-4-methoxy-1-propan-2-ylpyrazole
CID 114665739

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine?
The IUPAC name of 4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine (CID 114272278) is 4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine.
What is the SMILES notation for 4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine?
The canonical SMILES for 4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine is COc1cnn(C(C)C)c1C1CC(C)NC(C)C1.
What is the InChIKey of 4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine?
The InChIKey is FWPKDDUEWTYECC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-9(2)17-14(13(18-5)8-15-17)12-6-10(3)16-11(4)7-12/h8-12,16H,6-7H2,1-5H3.
What are the key properties of 4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine?
4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine has a molecular weight of 251.37 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine is sourced from PubChem (CID 114272278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).