(1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol

C13H17N3O2 — CID 83091118

IUPAC(1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol
SMILESCCOc1cncc(C(O)c2cn(C)nc2C)c1
InChIInChI=1S/C13H17N3O2/c1-4-18-11-5-10(6-14-7-11)13(17)12-8-16(3)15-9(12)2/h5-8,13,17H,4H2,1-3H3
InChIKeyDMLMOHLBICSMCO-UHFFFAOYSA-N
MW247.30 g/mol
LogP1.60
Rot. Bonds4

About (1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol

(1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol (PubChem CID 83091118) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is (1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol.

Molecular Properties

Compound Name(1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol
PubChem CID83091118
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name(1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol
SMILESCCOc1cncc(C(O)c2cn(C)nc2C)c1
InChIInChI=1S/C13H17N3O2/c1-4-18-11-5-10(6-14-7-11)13(17)12-8-16(3)15-9(12)2/h5-8,13,17H,4H2,1-3H3
InChIKeyDMLMOHLBICSMCO-UHFFFAOYSA-N
XLogP1.60
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol 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

[(1,3-dimethylpyrazol-4-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 102805151
(5-ethoxy-3-pyridinyl)-(2-fluoro-5-methylphenyl)methanol
CID 115828977
(1,3-dimethylpyrazol-4-yl)-(1-propylpyrazol-4-yl)methanol
CID 83091487
(5-ethoxy-3-pyridinyl)-(1-methylindazol-3-yl)methanol
CID 103129138
(1,3-dimethylpyrazol-4-yl)-(3-propan-2-yloxyphenyl)methanol
CID 83091659
(1,3-dimethylpyrazol-4-yl)-(4-methylphenyl)methanol
CID 83090741
(1,3-dimethylpyrazol-4-yl)-[3-(trifluoromethoxy)phenyl]methanol
CID 83090224
1-(5-ethoxy-3-pyridinyl)-3-ethylpentane-1,2-diol
CID 103459699
(2,5-dimethylfuran-3-yl)-(5-propoxy-3-pyridinyl)methanol
CID 115829129
(3-bromo-5-chlorophenyl)-(5-ethoxy-3-pyridinyl)methanol
CID 107947736
(1,3-dimethylpyrazol-4-yl)-(3-propylphenyl)methanol
CID 116542830
(4-tert-butylphenyl)-(1,3-dimethylpyrazol-4-yl)methanol
CID 83092098

Frequently Asked Questions

What is the IUPAC name of (1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol?
The IUPAC name of (1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol (CID 83091118) is (1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol.
What is the SMILES notation for (1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol?
The canonical SMILES for (1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol is CCOc1cncc(C(O)c2cn(C)nc2C)c1.
What is the InChIKey of (1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol?
The InChIKey is DMLMOHLBICSMCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-4-18-11-5-10(6-14-7-11)13(17)12-8-16(3)15-9(12)2/h5-8,13,17H,4H2,1-3H3.
What are the key properties of (1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol?
(1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol has a molecular weight of 247.30 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1,3-dimethylpyrazol-4-yl)-(5-ethoxy-3-pyridinyl)methanol is sourced from PubChem (CID 83091118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).