1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol

C16H24N2O2 — CID 64783113

IUPAC1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol
SMILESCCc1ccc(C(O)Cc2ccn(C(CC)CC)n2)o1
InChIInChI=1S/C16H24N2O2/c1-4-13(5-2)18-10-9-12(17-18)11-15(19)16-8-7-14(6-3)20-16/h7-10,13,15,19H,4-6,11H2,1-3H3
InChIKeyQRGGSDSULBUXEE-UHFFFAOYSA-N
MW276.38 g/mol
LogP3.68
Rot. Bonds7

About 1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol

1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol (PubChem CID 64783113) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol.

Molecular Properties

Compound Name1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol
PubChem CID64783113
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol
SMILESCCc1ccc(C(O)Cc2ccn(C(CC)CC)n2)o1
InChIInChI=1S/C16H24N2O2/c1-4-13(5-2)18-10-9-12(17-18)11-15(19)16-8-7-14(6-3)20-16/h7-10,13,15,19H,4-6,11H2,1-3H3
InChIKeyQRGGSDSULBUXEE-UHFFFAOYSA-N
XLogP3.68
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-pentan-3-ylpyrazol-3-yl)propan-2-ol
CID 64785051
1-(3-ethyl-1-methylpyrazol-5-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol
CID 105104073
1-(2-amino-5-fluorophenyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol
CID 82683168
1-(5-ethylfuran-2-yl)-2-(1-methyltriazol-4-yl)ethanol
CID 107045958
3-[(1-pentan-3-ylpyrazol-3-yl)methyl]pentan-2-ol
CID 64777467
1-(3-methylimidazol-4-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol
CID 66116921
1-(2-fluorophenyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol
CID 64783495
2-(1-butan-2-ylpyrazol-3-yl)-1-(5-ethylfuran-2-yl)-N-methylethanamine
CID 104989847
1-(6-methoxypyrimidin-4-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol
CID 102950291
1-methylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-ol
CID 64785470
2-(1-pentan-3-ylpyrazol-3-yl)-1-pyridin-3-ylethanol
CID 64784265
1-(1-pentan-3-ylpyrazol-3-yl)-3-propylhexan-2-ol
CID 115808024

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol?
The IUPAC name of 1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol (CID 64783113) is 1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol.
What is the SMILES notation for 1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol?
The canonical SMILES for 1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol is CCc1ccc(C(O)Cc2ccn(C(CC)CC)n2)o1.
What is the InChIKey of 1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol?
The InChIKey is QRGGSDSULBUXEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-13(5-2)18-10-9-12(17-18)11-15(19)16-8-7-14(6-3)20-16/h7-10,13,15,19H,4-6,11H2,1-3H3.
What are the key properties of 1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol?
1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol has a molecular weight of 276.38 g/mol, XLogP of 3.68, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylfuran-2-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol is sourced from PubChem (CID 64783113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).