2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol

C15H18N2O2 — CID 114743786

IUPAC2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)c1cccc2c1OCC2
InChIInChI=1S/C15H18N2O2/c1-2-9-17-13(6-8-16-17)14(18)12-5-3-4-11-7-10-19-15(11)12/h3-6,8,14,18H,2,7,9-10H2,1H3
InChIKeyWUISEIPLKFHVIU-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.31
Rot. Bonds4

About 2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol

2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol (PubChem CID 114743786) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol
PubChem CID114743786
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)c1cccc2c1OCC2
InChIInChI=1S/C15H18N2O2/c1-2-9-17-13(6-8-16-17)14(18)12-5-3-4-11-7-10-19-15(11)12/h3-6,8,14,18H,2,7,9-10H2,1H3
InChIKeyWUISEIPLKFHVIU-UHFFFAOYSA-N
XLogP2.31
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dihydro-1-benzofuran-7-yl-(1-propylpyrazol-4-yl)methanol
CID 103572734
(2,3-difluorophenyl)-(2-propylpyrazol-3-yl)methanol
CID 63975691
(2-aminophenyl)-(2-propylpyrazol-3-yl)methanol
CID 64831998
2,3-dihydro-1-benzofuran-7-yl-(1-methylimidazol-4-yl)methanol
CID 107978736
[2,3-dihydro-1,4-benzodioxin-5-yl-(2-propylpyrazol-3-yl)methyl]hydrazine
CID 105306987
2,3-dihydro-1-benzofuran-7-yl-(5-ethylfuran-2-yl)methanol
CID 114743365
(2-propoxyphenyl)-(2-propylpyrazol-3-yl)methanol
CID 114557016
1-(2,3-dihydro-1-benzofuran-7-yl)ethanol
CID 68614116
(2-propylpyrazol-3-yl)-[2-(trifluoromethoxy)phenyl]methanol
CID 63975892
(2-chlorophenyl)-(2,3-dihydro-1-benzofuran-7-yl)methanol
CID 114743289
2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol
CID 114744728
2,3-dihydro-1-benzofuran-7-yl(naphthalen-1-yl)methanol
CID 114743291

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol?
The IUPAC name of 2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol (CID 114743786) is 2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol.
What is the SMILES notation for 2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol?
The canonical SMILES for 2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol is CCCn1nccc1C(O)c1cccc2c1OCC2.
What is the InChIKey of 2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol?
The InChIKey is WUISEIPLKFHVIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-2-9-17-13(6-8-16-17)14(18)12-5-3-4-11-7-10-19-15(11)12/h3-6,8,14,18H,2,7,9-10H2,1H3.
What are the key properties of 2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol?
2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol has a molecular weight of 258.32 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1-benzofuran-7-yl-(2-propylpyrazol-3-yl)methanol is sourced from PubChem (CID 114743786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).