(6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol

C13H24O — CID 130488936

IUPAC(6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol
SMILESCCC1CCC2(CC1)C(CO)C2(C)C
InChIInChI=1S/C13H24O/c1-4-10-5-7-13(8-6-10)11(9-14)12(13,2)3/h10-11,14H,4-9H2,1-3H3
InChIKeyFCLGTHXQYOJCAH-UHFFFAOYSA-N
MW196.33 g/mol
LogP3.22
Rot. Bonds2

About (6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol

(6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol (PubChem CID 130488936) has the molecular formula C13H24O and a molecular weight of 196.33 g/mol. Its IUPAC name is (6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol.

Molecular Properties

Compound Name(6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol
PubChem CID130488936
Molecular FormulaC13H24O
Molecular Weight196.33 g/mol
Exact Mass196.18
IUPAC Name(6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol
SMILESCCC1CCC2(CC1)C(CO)C2(C)C
InChIInChI=1S/C13H24O/c1-4-10-5-7-13(8-6-10)11(9-14)12(13,2)3/h10-11,14H,4-9H2,1-3H3
InChIKeyFCLGTHXQYOJCAH-UHFFFAOYSA-N
XLogP3.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.33
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(6-ethyl-2,2-dimethylspiro[2.4]heptan-1-yl)methanol
CID 130488861
N-[(6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methyl]-2-methylpropan-1-amine
CID 114229867
(2,2-dimethyl-6-phenylspiro[2.5]octan-1-yl)methanol
CID 114229957
acetylene;4-ethyl-1,1-dimethylcyclohexane
CID 142009722
(1-amino-4-ethylcyclohexyl)methanol
CID 61055822
1,4-diethyl-1-methylcyclohexane;ethane
CID 144637328
(2,2-dimethyl-5-propan-2-ylspiro[2.3]hexan-1-yl)methanol
CID 130488897
2-tricyclo[1.1.1.01,3]pentanylmethanol
CID 10975409
4-ethyl-1-(hydroxymethyl)cycloheptan-1-ol
CID 82713966
2-(1-amino-3-ethylcyclopentyl)ethanol
CID 65239857
4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol
CID 65147481
4-ethyl-1-(4-ethylcyclohexyl)cycloheptan-1-ol
CID 65085835

Frequently Asked Questions

What is the IUPAC name of (6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol?
The IUPAC name of (6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol (CID 130488936) is (6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol.
What is the SMILES notation for (6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol?
The canonical SMILES for (6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol is CCC1CCC2(CC1)C(CO)C2(C)C.
What is the InChIKey of (6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol?
The InChIKey is FCLGTHXQYOJCAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O/c1-4-10-5-7-13(8-6-10)11(9-14)12(13,2)3/h10-11,14H,4-9H2,1-3H3.
What are the key properties of (6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol?
(6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol has a molecular weight of 196.33 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methanol is sourced from PubChem (CID 130488936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).