(1,4-dimethylpyrazol-3-yl)methanol

C6H10N2O — CID 55264682

IUPAC(1,4-dimethylpyrazol-3-yl)methanol
SMILESCc1cn(C)nc1CO
InChIInChI=1S/C6H10N2O/c1-5-3-8(2)7-6(5)4-9/h3,9H,4H2,1-2H3
InChIKeyOTUVGILLGRMINB-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.22
Rot. Bonds1

About (1,4-dimethylpyrazol-3-yl)methanol

(1,4-dimethylpyrazol-3-yl)methanol (PubChem CID 55264682) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is (1,4-dimethylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(1,4-dimethylpyrazol-3-yl)methanol
PubChem CID55264682
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name(1,4-dimethylpyrazol-3-yl)methanol
SMILESCc1cn(C)nc1CO
InChIInChI=1S/C6H10N2O/c1-5-3-8(2)7-6(5)4-9/h3,9H,4H2,1-2H3
InChIKeyOTUVGILLGRMINB-UHFFFAOYSA-N
XLogP0.22
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1,5-dimethyl-1H-pyrazol-4-yl)methanol
CID 4633353
(1,3-dimethyl-1H-pyrazol-4-yl)methanol
CID 949772
(1-methyl-1H-pyrazol-3-yl)methanol
CID 12845046
2-(1-Methyl-1H-pyrazol-4-yl)ethanol
CID 17028076
(4-Bromo-1-methyl-1H-pyrazol-3-yl)methanol
CID 24229713
(1-methyl-5-(trifluoromethyl)-1H-pyrazol-4-yl)methanol
CID 2807828
(1-ethyl-3-methyl-1H-pyrazol-4-yl)methanol
CID 786252
(1-methyl-1H-pyrazol-5-yl)methanol
CID 11815316
(1-ethyl-1H-pyrazol-3-yl)methanol
CID 22287713
(1-(propan-2-yl)-1H-pyrazol-3-yl)methanol
CID 23005538
(1-(difluoromethyl)-1H-pyrazol-3-yl)methanol
CID 50896816
(1-(2,2-difluoroethyl)-1H-pyrazol-3-yl)methanol
CID 50896840

Frequently Asked Questions

What is the IUPAC name of (1,4-dimethylpyrazol-3-yl)methanol?
The IUPAC name of (1,4-dimethylpyrazol-3-yl)methanol (CID 55264682) is (1,4-dimethylpyrazol-3-yl)methanol.
What is the SMILES notation for (1,4-dimethylpyrazol-3-yl)methanol?
The canonical SMILES for (1,4-dimethylpyrazol-3-yl)methanol is Cc1cn(C)nc1CO.
What is the InChIKey of (1,4-dimethylpyrazol-3-yl)methanol?
The InChIKey is OTUVGILLGRMINB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-5-3-8(2)7-6(5)4-9/h3,9H,4H2,1-2H3.
What are the key properties of (1,4-dimethylpyrazol-3-yl)methanol?
(1,4-dimethylpyrazol-3-yl)methanol has a molecular weight of 126.16 g/mol, XLogP of 0.22, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1,4-dimethylpyrazol-3-yl)methanol is sourced from PubChem (CID 55264682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).