(1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol

C10H18N2O — CID 123341518

IUPAC(1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol
SMILESCCCc1c(C)c(CO)nn1CC
InChIInChI=1S/C10H18N2O/c1-4-6-10-8(3)9(7-13)11-12(10)5-2/h13H,4-7H2,1-3H3
InChIKeyFPSADJLUEPIPPL-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.66
Rot. Bonds4

About (1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol

(1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol (PubChem CID 123341518) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is (1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol
PubChem CID123341518
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name(1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol
SMILESCCCc1c(C)c(CO)nn1CC
InChIInChI=1S/C10H18N2O/c1-4-6-10-8(3)9(7-13)11-12(10)5-2/h13H,4-7H2,1-3H3
InChIKeyFPSADJLUEPIPPL-UHFFFAOYSA-N
XLogP1.66
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol?
The IUPAC name of (1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol (CID 123341518) is (1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol.
What is the SMILES notation for (1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol?
The canonical SMILES for (1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol is CCCc1c(C)c(CO)nn1CC.
What is the InChIKey of (1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol?
The InChIKey is FPSADJLUEPIPPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-4-6-10-8(3)9(7-13)11-12(10)5-2/h13H,4-7H2,1-3H3.
What are the key properties of (1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol?
(1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol has a molecular weight of 182.27 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethyl-4-methyl-5-propylpyrazol-3-yl)methanol is sourced from PubChem (CID 123341518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).