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

C13H20O2 — CID 65148004

IUPAC1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol
SMILESCCCCC(O)c1ccc(C2CC2C)o1
InChIInChI=1S/C13H20O2/c1-3-4-5-11(14)13-7-6-12(15-13)10-8-9(10)2/h6-7,9-11,14H,3-5,8H2,1-2H3
InChIKeyMRXMGSPRNTWZNA-UHFFFAOYSA-N
MW208.30 g/mol
LogP3.63
Rot. Bonds5

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

1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol (PubChem CID 65148004) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is 1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol.

Molecular Properties

Compound Name1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol
PubChem CID65148004
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol
SMILESCCCCC(O)c1ccc(C2CC2C)o1
InChIInChI=1S/C13H20O2/c1-3-4-5-11(14)13-7-6-12(15-13)10-8-9(10)2/h6-7,9-11,14H,3-5,8H2,1-2H3
InChIKeyMRXMGSPRNTWZNA-UHFFFAOYSA-N
XLogP3.63
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol?
The IUPAC name of 1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol (CID 65148004) is 1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol.
What is the SMILES notation for 1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol?
The canonical SMILES for 1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol is CCCCC(O)c1ccc(C2CC2C)o1.
What is the InChIKey of 1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol?
The InChIKey is MRXMGSPRNTWZNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2/c1-3-4-5-11(14)13-7-6-12(15-13)10-8-9(10)2/h6-7,9-11,14H,3-5,8H2,1-2H3.
What are the key properties of 1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol?
1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol has a molecular weight of 208.30 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2-methylcyclopropyl)furan-2-yl]pentan-1-ol is sourced from PubChem (CID 65148004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).