4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol

C10H18N2O2 — CID 103008347

IUPAC4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol
SMILESCOC(C)C(O)CCc1ccnn1C
InChIInChI=1S/C10H18N2O2/c1-8(14-3)10(13)5-4-9-6-7-11-12(9)2/h6-8,10,13H,4-5H2,1-3H3
InChIKeyQJAMBNXLOUJZOW-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.75
Rot. Bonds5

About 4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol

4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol (PubChem CID 103008347) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol.

Molecular Properties

Compound Name4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol
PubChem CID103008347
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol
SMILESCOC(C)C(O)CCc1ccnn1C
InChIInChI=1S/C10H18N2O2/c1-8(14-3)10(13)5-4-9-6-7-11-12(9)2/h6-8,10,13H,4-5H2,1-3H3
InChIKeyQJAMBNXLOUJZOW-UHFFFAOYSA-N
XLogP0.75
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methylpyrazol-3-yl)hexane-3,4-diol
CID 103454643
1-(2-methylpyrazol-3-yl)pentan-3-ol
CID 64516316
1-(2-methylpyrazol-3-yl)-4-phenylpentan-3-ol
CID 103006232
4-(aminomethyl)-5-methyl-1-(2-methylpyrazol-3-yl)hexan-3-ol
CID 107443168
2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol
CID 103013814
5-methyl-1-(2-methylpyrazol-3-yl)heptan-3-ol
CID 103028111
1-(4-methoxyphenyl)-4-(2-methylpyrazol-3-yl)butan-2-ol
CID 103008038
6-(2-methylpyrazol-3-yl)hexane-1,4-diol
CID 106677975
5-(3-chlorobutyl)-1-methylpyrazole
CID 64514221
5-(3-bromobutyl)-1-methylpyrazole
CID 64509819
2-methyl-4-(2-methylpyrazol-3-yl)butanoic acid
CID 103005024
(2R)-1,1,1-trifluoro-4-(2-methylpyrazol-3-yl)butan-2-ol
CID 103008517

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol?
The IUPAC name of 4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol (CID 103008347) is 4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol.
What is the SMILES notation for 4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol?
The canonical SMILES for 4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol is COC(C)C(O)CCc1ccnn1C.
What is the InChIKey of 4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol?
The InChIKey is QJAMBNXLOUJZOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-8(14-3)10(13)5-4-9-6-7-11-12(9)2/h6-8,10,13H,4-5H2,1-3H3.
What are the key properties of 4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol?
4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol has a molecular weight of 198.27 g/mol, XLogP of 0.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol is sourced from PubChem (CID 103008347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).