3,5-dimethyl-1H-pyrazole;ethanol

C7H14N2O — CID 175303742

IUPAC3,5-dimethyl-1H-pyrazole;ethanol
SMILESCCO.Cc1cc(C)[nH]n1
InChIInChI=1S/C5H8N2.C2H6O/c1-4-3-5(2)7-6-4;1-2-3/h3H,1-2H3,(H,6,7);3H,2H2,1H3
InChIKeySQKVUEJHPIKNQS-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.03
Rot. Bonds

About 3,5-dimethyl-1H-pyrazole;ethanol

3,5-dimethyl-1H-pyrazole;ethanol (PubChem CID 175303742) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 3,5-dimethyl-1H-pyrazole;ethanol.

Molecular Properties

Compound Name3,5-dimethyl-1H-pyrazole;ethanol
PubChem CID175303742
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name3,5-dimethyl-1H-pyrazole;ethanol
SMILESCCO.Cc1cc(C)[nH]n1
InChIInChI=1S/C5H8N2.C2H6O/c1-4-3-5(2)7-6-4;1-2-3/h3H,1-2H3,(H,6,7);3H,2H2,1H3
InChIKeySQKVUEJHPIKNQS-UHFFFAOYSA-N
XLogP1.03
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

sodium;3,5-dimethyl-1H-pyrazole;hydride
CID 174789543
3,5-dimethyl-1H-pyrazole;methane;2-methylpropane
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CID 5255019
chloropalladium(1+);3,5-dimethyl-1H-pyrazole;bis(triethylphosphanium)
CID 6395787
3,5-dimethyl-1H-pyrazole;methanedithioic acid
CID 175518548
3,3-dimethylbutan-2-one;3,5-dimethyl-1H-pyrazole
CID 143661078
3,5-dimethyl-1H-pyrazole;pyridine
CID 174790538
4-chloro-3,5-dimethyl-1H-pyrazole;3,5-dimethyl-1H-pyrazole;pentane-2,4-dione;propan-2-one
CID 158693740
2-(5-methyl-1H-pyrazol-3-yl)propan-1-ol
CID 118928978
ethane;N-[(5-methyl-1H-pyrazol-3-yl)methyl]ethanamine
CID 171515765
dichloro(hydrido)rhodium;3,5-dimethyl-1H-pyrazole;bis(triphenylphosphanium)
CID 6395258
2-amino-2-(5-methyl-1H-pyrazol-3-yl)ethanol
CID 82594248

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1H-pyrazole;ethanol?
The IUPAC name of 3,5-dimethyl-1H-pyrazole;ethanol (CID 175303742) is 3,5-dimethyl-1H-pyrazole;ethanol.
What is the SMILES notation for 3,5-dimethyl-1H-pyrazole;ethanol?
The canonical SMILES for 3,5-dimethyl-1H-pyrazole;ethanol is CCO.Cc1cc(C)[nH]n1.
What is the InChIKey of 3,5-dimethyl-1H-pyrazole;ethanol?
The InChIKey is SQKVUEJHPIKNQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2.C2H6O/c1-4-3-5(2)7-6-4;1-2-3/h3H,1-2H3,(H,6,7);3H,2H2,1H3.
What are the key properties of 3,5-dimethyl-1H-pyrazole;ethanol?
3,5-dimethyl-1H-pyrazole;ethanol has a molecular weight of 142.20 g/mol, XLogP of 1.03, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1H-pyrazole;ethanol is sourced from PubChem (CID 175303742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).