3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol

C13H24N2O2 — CID 82929019

IUPAC3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol
SMILESCCC(CC)CC(O)c1c(C)nn(C)c1OC
InChIInChI=1S/C13H24N2O2/c1-6-10(7-2)8-11(16)12-9(3)14-15(4)13(12)17-5/h10-11,16H,6-8H2,1-5H3
InChIKeyLPZRNXSAAQBDOS-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.60
Rot. Bonds6

About 3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol

3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol (PubChem CID 82929019) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol.

Molecular Properties

Compound Name3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol
PubChem CID82929019
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol
SMILESCCC(CC)CC(O)c1c(C)nn(C)c1OC
InChIInChI=1S/C13H24N2O2/c1-6-10(7-2)8-11(16)12-9(3)14-15(4)13(12)17-5/h10-11,16H,6-8H2,1-5H3
InChIKeyLPZRNXSAAQBDOS-UHFFFAOYSA-N
XLogP2.60
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-3-amino-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)propan-1-ol
CID 96859628
1-(5-methoxy-1,3-dimethylpyrazol-4-yl)-2-methylpentan-1-ol
CID 107892711
methyl 2-(5-methoxy-1,3-dimethylpyrazol-4-yl)-2-(propylamino)acetate
CID 113463447
3-methyl-1-(1,3,5-trimethylpyrazol-4-yl)butan-1-ol
CID 105076282
1-(2,5-dimethylpyrazol-3-yl)-3-ethylpentan-1-ol
CID 105122554
4-ethyl-1-(1,3,5-trimethylpyrazol-4-yl)hexan-2-ol
CID 105122498
(5-ethyl-1,2,4-oxadiazol-3-yl)-(5-methoxy-1,3-dimethylpyrazol-4-yl)methanamine
CID 113463486
cyclohepten-1-yl-(5-methoxy-1,3-dimethylpyrazol-4-yl)methanol
CID 106651334
(4-bromo-1,3-thiazol-5-yl)-(5-methoxy-1,3-dimethylpyrazol-4-yl)methanol
CID 114102815
2-(3-hydroxypropoxy)-2-(5-methoxy-1,3-dimethylpyrazol-4-yl)acetic acid
CID 113463581
4-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methylamino]pentan-2-ol
CID 113381760
3,4-dihydro-2H-pyran-6-yl-(5-methoxy-1,3-dimethylpyrazol-4-yl)methanol
CID 102646637

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol?
The IUPAC name of 3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol (CID 82929019) is 3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol.
What is the SMILES notation for 3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol?
The canonical SMILES for 3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol is CCC(CC)CC(O)c1c(C)nn(C)c1OC.
What is the InChIKey of 3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol?
The InChIKey is LPZRNXSAAQBDOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-6-10(7-2)8-11(16)12-9(3)14-15(4)13(12)17-5/h10-11,16H,6-8H2,1-5H3.
What are the key properties of 3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol?
3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol has a molecular weight of 240.35 g/mol, XLogP of 2.60, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(5-methoxy-1,3-dimethylpyrazol-4-yl)pentan-1-ol is sourced from PubChem (CID 82929019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).