1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol

C13H15NO2 — CID 105122992

IUPAC1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol
SMILESOC(CCc1ccccn1)Cc1ccco1
InChIInChI=1S/C13H15NO2/c15-12(10-13-5-3-9-16-13)7-6-11-4-1-2-8-14-11/h1-5,8-9,12,15H,6-7,10H2
InChIKeyPVUQIBUIHUFPTR-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.21
Rot. Bonds5

About 1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol

1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol (PubChem CID 105122992) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is 1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol.

Molecular Properties

Compound Name1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol
PubChem CID105122992
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol
SMILESOC(CCc1ccccn1)Cc1ccco1
InChIInChI=1S/C13H15NO2/c15-12(10-13-5-3-9-16-13)7-6-11-4-1-2-8-14-11/h1-5,8-9,12,15H,6-7,10H2
InChIKeyPVUQIBUIHUFPTR-UHFFFAOYSA-N
XLogP2.21
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(furan-2-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine
CID 105331567
1-(4-ethylphenyl)-4-pyridin-2-ylbutan-2-ol
CID 105080302
1-(5-bromothiophen-2-yl)-4-pyridin-2-ylbutan-2-ol
CID 105087342
1-(furan-2-yl)hexan-2-ol
CID 83171633
1-(furan-2-yl)-5-methoxyhexan-2-ol
CID 105122918
1-(2-methyl-1,3-thiazol-4-yl)-4-pyridin-2-ylbutan-2-ol
CID 105106766
1-propoxy-4-pyridin-2-ylbutan-2-ol
CID 105112007
2-[4-pyridin-2-yl-2-(2-pyridin-2-ylethyl)butyl]pyridine
CID 175722818
1-pyridin-2-yldec-9-en-3-ol
CID 107012287
1-(3-bromo-2,6-difluorophenyl)-4-pyridin-2-ylbutan-2-ol
CID 106274491
2-(furan-2-yl)-1-pyridin-2-ylethanamine
CID 83175887
2-(furan-2-yl)ethane-1,1-diol
CID 156698008

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol?
The IUPAC name of 1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol (CID 105122992) is 1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol.
What is the SMILES notation for 1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol?
The canonical SMILES for 1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol is OC(CCc1ccccn1)Cc1ccco1.
What is the InChIKey of 1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol?
The InChIKey is PVUQIBUIHUFPTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c15-12(10-13-5-3-9-16-13)7-6-11-4-1-2-8-14-11/h1-5,8-9,12,15H,6-7,10H2.
What are the key properties of 1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol?
1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol has a molecular weight of 217.27 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-4-pyridin-2-ylbutan-2-ol is sourced from PubChem (CID 105122992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).