(6-ethylspiro[3.3]heptan-2-yl)methanol

C10H18O — CID 122429211

IUPAC(6-ethylspiro[3.3]heptan-2-yl)methanol
SMILESCCC1CC2(C1)CC(CO)C2
InChIInChI=1S/C10H18O/c1-2-8-3-10(4-8)5-9(6-10)7-11/h8-9,11H,2-7H2,1H3
InChIKeyJMUJLYCRRBJTQE-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.20
Rot. Bonds2

About (6-ethylspiro[3.3]heptan-2-yl)methanol

(6-ethylspiro[3.3]heptan-2-yl)methanol (PubChem CID 122429211) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (6-ethylspiro[3.3]heptan-2-yl)methanol.

Molecular Properties

Compound Name(6-ethylspiro[3.3]heptan-2-yl)methanol
PubChem CID122429211
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(6-ethylspiro[3.3]heptan-2-yl)methanol
SMILESCCC1CC2(C1)CC(CO)C2
InChIInChI=1S/C10H18O/c1-2-8-3-10(4-8)5-9(6-10)7-11/h8-9,11H,2-7H2,1H3
InChIKeyJMUJLYCRRBJTQE-UHFFFAOYSA-N
XLogP2.20
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (6-ethylspiro[3.3]heptan-2-yl)methanol?
The IUPAC name of (6-ethylspiro[3.3]heptan-2-yl)methanol (CID 122429211) is (6-ethylspiro[3.3]heptan-2-yl)methanol.
What is the SMILES notation for (6-ethylspiro[3.3]heptan-2-yl)methanol?
The canonical SMILES for (6-ethylspiro[3.3]heptan-2-yl)methanol is CCC1CC2(C1)CC(CO)C2.
What is the InChIKey of (6-ethylspiro[3.3]heptan-2-yl)methanol?
The InChIKey is JMUJLYCRRBJTQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-2-8-3-10(4-8)5-9(6-10)7-11/h8-9,11H,2-7H2,1H3.
What are the key properties of (6-ethylspiro[3.3]heptan-2-yl)methanol?
(6-ethylspiro[3.3]heptan-2-yl)methanol has a molecular weight of 154.25 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-ethylspiro[3.3]heptan-2-yl)methanol is sourced from PubChem (CID 122429211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).