2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol

C11H18N2O — CID 115779051

IUPAC2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol
SMILESCCn1cc(C(O)C(C)C2CC2)cn1
InChIInChI=1S/C11H18N2O/c1-3-13-7-10(6-12-13)11(14)8(2)9-4-5-9/h6-9,11,14H,3-5H2,1-2H3
InChIKeyMLVLCZQBFIITDJ-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.98
Rot. Bonds4

About 2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol

2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol (PubChem CID 115779051) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol
PubChem CID115779051
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol
SMILESCCn1cc(C(O)C(C)C2CC2)cn1
InChIInChI=1S/C11H18N2O/c1-3-13-7-10(6-12-13)11(14)8(2)9-4-5-9/h6-9,11,14H,3-5H2,1-2H3
InChIKeyMLVLCZQBFIITDJ-UHFFFAOYSA-N
XLogP1.98
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1-ethylpyrazol-4-yl)propane-1,2-diol
CID 103452757
2-cyclopropyl-1-(1-ethylpyrazol-4-yl)-N-methylpropan-1-amine
CID 115816197
2-ethyl-1-(1-ethylpyrazol-4-yl)butan-1-ol
CID 63894691
1-(1-ethylpyrazol-4-yl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 65423611
2-amino-1-(1-ethylpyrazol-4-yl)butan-1-ol
CID 103570009
cyclooctyl-(1-ethylpyrazol-4-yl)methanamine
CID 80603190
2-[(1-ethylpyrazol-4-yl)-hydroxymethyl]-3-methylbutanoic acid
CID 103570644
2-cyclopentyl-1-(1-ethylpyrazol-4-yl)ethanamine
CID 115816159
4-(1-ethylpyrazol-4-yl)-4-hydroxy-3-methylbutanoic acid
CID 103570340
2-amino-1-(1-ethylpyrazol-4-yl)ethanol
CID 55264385
(1-ethylpyrazol-4-yl)-(2-methylcyclopropyl)methanol
CID 65420163
cycloheptyl-(1-propylpyrazol-4-yl)methanol
CID 65398920

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol?
The IUPAC name of 2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol (CID 115779051) is 2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol is CCn1cc(C(O)C(C)C2CC2)cn1.
What is the InChIKey of 2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol?
The InChIKey is MLVLCZQBFIITDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-3-13-7-10(6-12-13)11(14)8(2)9-4-5-9/h6-9,11,14H,3-5H2,1-2H3.
What are the key properties of 2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol?
2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol has a molecular weight of 194.28 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(1-ethylpyrazol-4-yl)propan-1-ol is sourced from PubChem (CID 115779051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).