4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol

C14H22O2 — CID 65148398

IUPAC4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol
SMILESCC(C)CCC(O)c1ccc(C2CC2C)o1
InChIInChI=1S/C14H22O2/c1-9(2)4-5-12(15)14-7-6-13(16-14)11-8-10(11)3/h6-7,9-12,15H,4-5,8H2,1-3H3
InChIKeyRTVTYLDZCIGALF-UHFFFAOYSA-N
MW222.33 g/mol
LogP3.87
Rot. Bonds5

About 4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol

4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol (PubChem CID 65148398) has the molecular formula C14H22O2 and a molecular weight of 222.33 g/mol. Its IUPAC name is 4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol.

Molecular Properties

Compound Name4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol
PubChem CID65148398
Molecular FormulaC14H22O2
Molecular Weight222.33 g/mol
Exact Mass222.16
IUPAC Name4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol
SMILESCC(C)CCC(O)c1ccc(C2CC2C)o1
InChIInChI=1S/C14H22O2/c1-9(2)4-5-12(15)14-7-6-13(16-14)11-8-10(11)3/h6-7,9-12,15H,4-5,8H2,1-3H3
InChIKeyRTVTYLDZCIGALF-UHFFFAOYSA-N
XLogP3.87
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol?
The IUPAC name of 4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol (CID 65148398) is 4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol.
What is the SMILES notation for 4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol?
The canonical SMILES for 4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol is CC(C)CCC(O)c1ccc(C2CC2C)o1.
What is the InChIKey of 4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol?
The InChIKey is RTVTYLDZCIGALF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O2/c1-9(2)4-5-12(15)14-7-6-13(16-14)11-8-10(11)3/h6-7,9-12,15H,4-5,8H2,1-3H3.
What are the key properties of 4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol?
4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol has a molecular weight of 222.33 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol is sourced from PubChem (CID 65148398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).