(7-propylspiro[3.5]nonan-7-yl)methanol

C13H24O — CID 89164695

IUPAC(7-propylspiro[3.5]nonan-7-yl)methanol
SMILESCCCC1(CO)CCC2(CCC2)CC1
InChIInChI=1S/C13H24O/c1-2-4-13(11-14)9-7-12(8-10-13)5-3-6-12/h14H,2-11H2,1H3
InChIKeyODYDZZDMUTXUDH-UHFFFAOYSA-N
MW196.33 g/mol
LogP3.51
Rot. Bonds3

About (7-propylspiro[3.5]nonan-7-yl)methanol

(7-propylspiro[3.5]nonan-7-yl)methanol (PubChem CID 89164695) has the molecular formula C13H24O and a molecular weight of 196.33 g/mol. Its IUPAC name is (7-propylspiro[3.5]nonan-7-yl)methanol.

Molecular Properties

Compound Name(7-propylspiro[3.5]nonan-7-yl)methanol
PubChem CID89164695
Molecular FormulaC13H24O
Molecular Weight196.33 g/mol
Exact Mass196.18
IUPAC Name(7-propylspiro[3.5]nonan-7-yl)methanol
SMILESCCCC1(CO)CCC2(CCC2)CC1
InChIInChI=1S/C13H24O/c1-2-4-13(11-14)9-7-12(8-10-13)5-3-6-12/h14H,2-11H2,1H3
InChIKeyODYDZZDMUTXUDH-UHFFFAOYSA-N
XLogP3.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.33
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (7-propylspiro[3.5]nonan-7-yl)methanol?
The IUPAC name of (7-propylspiro[3.5]nonan-7-yl)methanol (CID 89164695) is (7-propylspiro[3.5]nonan-7-yl)methanol.
What is the SMILES notation for (7-propylspiro[3.5]nonan-7-yl)methanol?
The canonical SMILES for (7-propylspiro[3.5]nonan-7-yl)methanol is CCCC1(CO)CCC2(CCC2)CC1.
What is the InChIKey of (7-propylspiro[3.5]nonan-7-yl)methanol?
The InChIKey is ODYDZZDMUTXUDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O/c1-2-4-13(11-14)9-7-12(8-10-13)5-3-6-12/h14H,2-11H2,1H3.
What are the key properties of (7-propylspiro[3.5]nonan-7-yl)methanol?
(7-propylspiro[3.5]nonan-7-yl)methanol has a molecular weight of 196.33 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7-propylspiro[3.5]nonan-7-yl)methanol is sourced from PubChem (CID 89164695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).