3-(3,5-diethylpyrazol-1-yl)propan-1-ol

C10H18N2O — CID 82694262

IUPAC3-(3,5-diethylpyrazol-1-yl)propan-1-ol
SMILESCCc1cc(CC)n(CCCO)n1
InChIInChI=1S/C10H18N2O/c1-3-9-8-10(4-2)12(11-9)6-5-7-13/h8,13H,3-7H2,1-2H3
InChIKeyPYMAUFXUYZDXMV-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.39
Rot. Bonds5

About 3-(3,5-diethylpyrazol-1-yl)propan-1-ol

3-(3,5-diethylpyrazol-1-yl)propan-1-ol (PubChem CID 82694262) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 3-(3,5-diethylpyrazol-1-yl)propan-1-ol.

Molecular Properties

Compound Name3-(3,5-diethylpyrazol-1-yl)propan-1-ol
PubChem CID82694262
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name3-(3,5-diethylpyrazol-1-yl)propan-1-ol
SMILESCCc1cc(CC)n(CCCO)n1
InChIInChI=1S/C10H18N2O/c1-3-9-8-10(4-2)12(11-9)6-5-7-13/h8,13H,3-7H2,1-2H3
InChIKeyPYMAUFXUYZDXMV-UHFFFAOYSA-N
XLogP1.39
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-diethyl-1-propylpyrazole
CID 82699697
5-(3,5-diethylpyrazol-1-yl)pentanoic acid
CID 82693000
4-(3,5-diethylpyrazol-1-yl)-N-methylbutanamide
CID 82699974
(3-ethyl-1-propylpyrazol-5-yl)methanol
CID 122663118
5-(3,5-diethylpyrazol-1-yl)-N'-hydroxypentanimidamide
CID 82695391
1-(3,3-dimethylbutyl)-3,5-diethylpyrazole
CID 82698927
5-(3,5-diethylpyrazol-1-yl)-2-ethyl-2-(propan-2-ylamino)pentan-1-ol
CID 106810128
1-(3-ethyl-1-methylpyrazol-5-yl)-5-hydroxypentan-2-one
CID 106677524
5-(3,5-diethylpyrazol-1-yl)-2,2-dimethylpentanenitrile
CID 82692715
3,5-diethyl-1-[3-(2,2,2-trifluoroethoxy)propyl]pyrazole
CID 82699534
3,5-diethyl-1-(2-propoxyethyl)pyrazole
CID 106458013
3-(3,5-diethylpyrazol-1-yl)-N,N-dimethylpropanamide
CID 82700121

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-diethylpyrazol-1-yl)propan-1-ol?
The IUPAC name of 3-(3,5-diethylpyrazol-1-yl)propan-1-ol (CID 82694262) is 3-(3,5-diethylpyrazol-1-yl)propan-1-ol.
What is the SMILES notation for 3-(3,5-diethylpyrazol-1-yl)propan-1-ol?
The canonical SMILES for 3-(3,5-diethylpyrazol-1-yl)propan-1-ol is CCc1cc(CC)n(CCCO)n1.
What is the InChIKey of 3-(3,5-diethylpyrazol-1-yl)propan-1-ol?
The InChIKey is PYMAUFXUYZDXMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-3-9-8-10(4-2)12(11-9)6-5-7-13/h8,13H,3-7H2,1-2H3.
What are the key properties of 3-(3,5-diethylpyrazol-1-yl)propan-1-ol?
3-(3,5-diethylpyrazol-1-yl)propan-1-ol has a molecular weight of 182.27 g/mol, XLogP of 1.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-diethylpyrazol-1-yl)propan-1-ol is sourced from PubChem (CID 82694262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).