1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol

C11H18N2O — CID 79332586

IUPAC1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol
SMILESCCCC1CC1(O)c1cc(C)nn1C
InChIInChI=1S/C11H18N2O/c1-4-5-9-7-11(9,14)10-6-8(2)12-13(10)3/h6,9,14H,4-5,7H2,1-3H3
InChIKeyLHFCKAAHQNTNFB-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.74
Rot. Bonds3

About 1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol

1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol (PubChem CID 79332586) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol.

Molecular Properties

Compound Name1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol
PubChem CID79332586
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol
SMILESCCCC1CC1(O)c1cc(C)nn1C
InChIInChI=1S/C11H18N2O/c1-4-5-9-7-11(9,14)10-6-8(2)12-13(10)3/h6,9,14H,4-5,7H2,1-3H3
InChIKeyLHFCKAAHQNTNFB-UHFFFAOYSA-N
XLogP1.74
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol?
The IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol (CID 79332586) is 1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol.
What is the SMILES notation for 1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol?
The canonical SMILES for 1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol is CCCC1CC1(O)c1cc(C)nn1C.
What is the InChIKey of 1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol?
The InChIKey is LHFCKAAHQNTNFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-4-5-9-7-11(9,14)10-6-8(2)12-13(10)3/h6,9,14H,4-5,7H2,1-3H3.
What are the key properties of 1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol?
1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol has a molecular weight of 194.28 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylpyrazol-3-yl)-2-propylcyclopropan-1-ol is sourced from PubChem (CID 79332586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).