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

C11H20N2O — CID 166083003

IUPAC5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol
SMILESCCCn1nc(C(C)C)c(O)c1CC
InChIInChI=1S/C11H20N2O/c1-5-7-13-9(6-2)11(14)10(12-13)8(3)4/h8,14H,5-7H2,1-4H3
InChIKeyCYMPFNPLGZJYDB-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.68
Rot. Bonds4

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

5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol (PubChem CID 166083003) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol.

Molecular Properties

Compound Name5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol
PubChem CID166083003
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol
SMILESCCCn1nc(C(C)C)c(O)c1CC
InChIInChI=1S/C11H20N2O/c1-5-7-13-9(6-2)11(14)10(12-13)8(3)4/h8,14H,5-7H2,1-4H3
InChIKeyCYMPFNPLGZJYDB-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-ethyl-3-propan-2-yl-5-propylpyrazol-4-ol
CID 166083036
1-methyl-3-propan-2-yl-5-propylpyrazol-4-ol
CID 166083095
1-butyl-3,5-di(propan-2-yl)pyrazol-4-ol
CID 166083041
3-butan-2-yl-1-(2-methylpropyl)-5-propylpyrazol-4-ol
CID 166083128
5-ethenyl-4-iodo-3-propan-2-yl-1-propylpyrazole
CID 118995263
5-chloro-3-propan-2-yl-1-propylpyrazole-4-carbaldehyde
CID 61267063
1-(3,5-diethyl-1-pentylpyrazol-4-yl)ethanol
CID 82698165
5-butan-2-yl-3-(2-methylpropyl)-1-propylpyrazol-4-ol
CID 170563081
1-(3,5-diethyl-1-pentylpyrazol-4-yl)ethanamine
CID 82697450
4-chloro-3-propan-2-yl-1-propylpyrazole
CID 90195347
1-butyl-4-(1-chloroethyl)-3,5-diethylpyrazole
CID 82699491
5-ethyl-1-propyltriazol-4-amine
CID 79542542

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol?
The IUPAC name of 5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol (CID 166083003) is 5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol.
What is the SMILES notation for 5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol?
The canonical SMILES for 5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol is CCCn1nc(C(C)C)c(O)c1CC.
What is the InChIKey of 5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol?
The InChIKey is CYMPFNPLGZJYDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-5-7-13-9(6-2)11(14)10(12-13)8(3)4/h8,14H,5-7H2,1-4H3.
What are the key properties of 5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol?
5-ethyl-3-propan-2-yl-1-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 5-ethyl-3-propan-2-yl-1-propylpyrazol-4-ol is sourced from PubChem (CID 166083003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).