4-(oxolan-3-yl)-5-propyl-1H-pyrazole

C10H16N2O — CID 57139432

IUPAC4-(oxolan-3-yl)-5-propyl-1H-pyrazole
SMILESCCCc1[nH]ncc1C1CCOC1
InChIInChI=1S/C10H16N2O/c1-2-3-10-9(6-11-12-10)8-4-5-13-7-8/h6,8H,2-5,7H2,1H3,(H,11,12)
InChIKeyWZUROLOENZEBKT-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.87
Rot. Bonds3

About 4-(oxolan-3-yl)-5-propyl-1H-pyrazole

4-(oxolan-3-yl)-5-propyl-1H-pyrazole (PubChem CID 57139432) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 4-(oxolan-3-yl)-5-propyl-1H-pyrazole.

Molecular Properties

Compound Name4-(oxolan-3-yl)-5-propyl-1H-pyrazole
PubChem CID57139432
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name4-(oxolan-3-yl)-5-propyl-1H-pyrazole
SMILESCCCc1[nH]ncc1C1CCOC1
InChIInChI=1S/C10H16N2O/c1-2-3-10-9(6-11-12-10)8-4-5-13-7-8/h6,8H,2-5,7H2,1H3,(H,11,12)
InChIKeyWZUROLOENZEBKT-UHFFFAOYSA-N
XLogP1.87
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(oxolan-3-yl)-5-propyl-1H-pyrazole 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

4-(oxan-3-yl)-5-propyl-1H-pyrazole
CID 53826315
5-ethyl-4-(2-propan-2-yl-1,3-dioxepan-5-yl)-1H-pyrazole
CID 54445802
4-tert-butyl-5-(2-methoxyethyl)-1H-pyrazole
CID 58477502
5-[(2S,3S,4R,5S)-3,4,5-trimethyloxolan-2-yl]-1H-pyrazole
CID 59923399
5-[(3S,4R,5S)-3,4,5-trimethyloxolan-2-yl]-1H-pyrazole
CID 59927515
4-ethyl-5-(2-methoxyethyl)-1H-pyrazole
CID 68223161
ethyl 3-[3-(1-ethylpropyl)-1H-pyrazol-4-yl]propanoate
CID 69643883
3-(1-ethylpropyl)-4-[3-(methoxymethoxy)propyl]-1H-pyrazole
CID 69644099
3-isopropyl-4-[3-(methoxymethoxy)propyl]-1H-pyrazole
CID 69644168
5-(oxolan-3-yl)-1H-pyrazole-4-carbonitrile
CID 82415145
4-Methyl-3-(tetrahydro-3-furanyl)-1H-pyrazole
CID 90029563
3-(2-Methoxyethyl)-4-methyl-1H-pyrazole
CID 90030140

Frequently Asked Questions

What is the IUPAC name of 4-(oxolan-3-yl)-5-propyl-1H-pyrazole?
The IUPAC name of 4-(oxolan-3-yl)-5-propyl-1H-pyrazole (CID 57139432) is 4-(oxolan-3-yl)-5-propyl-1H-pyrazole.
What is the SMILES notation for 4-(oxolan-3-yl)-5-propyl-1H-pyrazole?
The canonical SMILES for 4-(oxolan-3-yl)-5-propyl-1H-pyrazole is CCCc1[nH]ncc1C1CCOC1.
What is the InChIKey of 4-(oxolan-3-yl)-5-propyl-1H-pyrazole?
The InChIKey is WZUROLOENZEBKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-2-3-10-9(6-11-12-10)8-4-5-13-7-8/h6,8H,2-5,7H2,1H3,(H,11,12).
What are the key properties of 4-(oxolan-3-yl)-5-propyl-1H-pyrazole?
4-(oxolan-3-yl)-5-propyl-1H-pyrazole has a molecular weight of 180.25 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxolan-3-yl)-5-propyl-1H-pyrazole is sourced from PubChem (CID 57139432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).