5-cyclopropylpentan-2-ol

C8H16O — CID 67118909

IUPAC5-cyclopropylpentan-2-ol
SMILESCC(O)CCCC1CC1
InChIInChI=1S/C8H16O/c1-7(9)3-2-4-8-5-6-8/h7-9H,2-6H2,1H3
InChIKeyNJDMSHCENRLBFZ-UHFFFAOYSA-N
MW128.21 g/mol
LogP1.95
Rot. Bonds4

About 5-cyclopropylpentan-2-ol

5-cyclopropylpentan-2-ol (PubChem CID 67118909) has the molecular formula C8H16O and a molecular weight of 128.21 g/mol. Its IUPAC name is 5-cyclopropylpentan-2-ol.

Molecular Properties

Compound Name5-cyclopropylpentan-2-ol
PubChem CID67118909
Molecular FormulaC8H16O
Molecular Weight128.21 g/mol
Exact Mass128.12
IUPAC Name5-cyclopropylpentan-2-ol
SMILESCC(O)CCCC1CC1
InChIInChI=1S/C8H16O/c1-7(9)3-2-4-8-5-6-8/h7-9H,2-6H2,1H3
InChIKeyNJDMSHCENRLBFZ-UHFFFAOYSA-N
XLogP1.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.21
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropylpentan-2-ol?
The IUPAC name of 5-cyclopropylpentan-2-ol (CID 67118909) is 5-cyclopropylpentan-2-ol.
What is the SMILES notation for 5-cyclopropylpentan-2-ol?
The canonical SMILES for 5-cyclopropylpentan-2-ol is CC(O)CCCC1CC1.
What is the InChIKey of 5-cyclopropylpentan-2-ol?
The InChIKey is NJDMSHCENRLBFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O/c1-7(9)3-2-4-8-5-6-8/h7-9H,2-6H2,1H3.
What are the key properties of 5-cyclopropylpentan-2-ol?
5-cyclopropylpentan-2-ol has a molecular weight of 128.21 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropylpentan-2-ol is sourced from PubChem (CID 67118909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).