1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol

C11H20N2O — CID 166083036

IUPAC1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol
SMILESCCCc1c(O)c(C(C)C)nn1CC
InChIInChI=1S/C11H20N2O/c1-5-7-9-11(14)10(8(3)4)12-13(9)6-2/h8,14H,5-7H2,1-4H3
InChIKeyQDCKJUHLHSZULK-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.68
Rot. Bonds4

About 1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol

1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol (PubChem CID 166083036) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol.

Molecular Properties

Compound Name1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol
PubChem CID166083036
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol
SMILESCCCc1c(O)c(C(C)C)nn1CC
InChIInChI=1S/C11H20N2O/c1-5-7-9-11(14)10(8(3)4)12-13(9)6-2/h8,14H,5-7H2,1-4H3
InChIKeyQDCKJUHLHSZULK-UHFFFAOYSA-N
XLogP2.68
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-3-propan-2-yl-5-propylpyrazol-4-ol
CID 166083095
5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol
CID 166083003
3-butan-2-yl-1-(2-methylpropyl)-5-propylpyrazol-4-ol
CID 166083128
1-butyl-3,5-di(propan-2-yl)pyrazol-4-ol
CID 166083041
1-butyl-4-propan-2-yl-5-propyltriazole
CID 69385473
1-ethyl-3-methyl-5-propylpyrazol-4-amine
CID 130537699
3-tert-butyl-1-propan-2-yl-5-propylpyrazol-4-ol
CID 166082944
1-(1-ethyl-5-propylpyrazol-4-yl)ethanamine
CID 105439739
2-(1-ethyl-5-propylpyrazol-4-yl)propanoic acid
CID 105464288
4-(bromomethyl)-1-ethyl-5-propylpyrazole
CID 66437286
2-(2-cyclohexylethyl)-5-hydroxy-3-oxo-6-propan-2-ylpyridazine-4-carbaldehyde
CID 136623324
1-ethyl-4,5-dipropyltriazole
CID 69383163

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol?
The IUPAC name of 1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol (CID 166083036) is 1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol.
What is the SMILES notation for 1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol?
The canonical SMILES for 1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol is CCCc1c(O)c(C(C)C)nn1CC.
What is the InChIKey of 1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol?
The InChIKey is QDCKJUHLHSZULK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-5-7-9-11(14)10(8(3)4)12-13(9)6-2/h8,14H,5-7H2,1-4H3.
What are the key properties of 1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol?
1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol has a molecular weight of 196.29 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol is sourced from PubChem (CID 166083036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).