4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol

C12H12N2O2 — CID 105469602

IUPAC4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol
SMILESCc1nn(-c2ccc(O)cc2)c2c1COC2
InChIInChI=1S/C12H12N2O2/c1-8-11-6-16-7-12(11)14(13-8)9-2-4-10(15)5-3-9/h2-5,15H,6-7H2,1H3
InChIKeyVTKZIGQRUJXHPY-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.92
Rot. Bonds1

About 4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol

4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol (PubChem CID 105469602) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol.

Molecular Properties

Compound Name4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol
PubChem CID105469602
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol
SMILESCc1nn(-c2ccc(O)cc2)c2c1COC2
InChIInChI=1S/C12H12N2O2/c1-8-11-6-16-7-12(11)14(13-8)9-2-4-10(15)5-3-9/h2-5,15H,6-7H2,1H3
InChIKeyVTKZIGQRUJXHPY-UHFFFAOYSA-N
XLogP1.92
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(4-methylphenyl)-4,6-dihydrofuro[3,4-d]pyrazol-3-yl]methanamine
CID 83862221
[2-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenyl]methanamine
CID 105486775
1-(4-chlorophenyl)-4,6-dihydrofuro[3,4-d]pyrazol-3-amine
CID 83868838
1-(4-hydroxyphenyl)-3-methyl-4,5,6,7-tetrahydroindazole-7-carboxylic acid
CID 115058216
[1-(4-fluorophenyl)-4,6-dihydrofuro[3,4-d]pyrazol-3-yl]methanamine
CID 83862222
4-(5-amino-3-methylpyrazol-1-yl)phenol
CID 21432541
4-[3-(4-methylphenyl)-5-(oxan-4-ylamino)-1,2,4-triazol-1-yl]phenol
CID 167212073
2-(3-methyl-5,7-dihydro-4H-pyrano[4,3-d]pyrazol-1-yl)aniline
CID 105486767
3-methyl-1-[4-(morpholine-4-carbonyl)phenyl]-6,7-dihydro-5H-indazol-4-one
CID 46364370
1-(4-bromophenyl)-3-methyl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine
CID 82586524
4-[3-(methylamino)-5,6-dihydro-4H-cyclopenta[c]pyrazol-2-yl]phenol
CID 83862475
4-[[3,5-dimethyl-1-(4-nitrophenyl)pyrazol-4-yl]diazenyl]phenol
CID 156630994

Frequently Asked Questions

What is the IUPAC name of 4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol?
The IUPAC name of 4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol (CID 105469602) is 4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol.
What is the SMILES notation for 4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol?
The canonical SMILES for 4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol is Cc1nn(-c2ccc(O)cc2)c2c1COC2.
What is the InChIKey of 4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol?
The InChIKey is VTKZIGQRUJXHPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-8-11-6-16-7-12(11)14(13-8)9-2-4-10(15)5-3-9/h2-5,15H,6-7H2,1H3.
What are the key properties of 4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol?
4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol has a molecular weight of 216.24 g/mol, XLogP of 1.92, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methyl-4,6-dihydrofuro[3,4-d]pyrazol-1-yl)phenol is sourced from PubChem (CID 105469602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).