spiro[2.4]heptan-7-ylmethanol

C8H14O — CID 149455832

IUPACspiro[2.4]heptan-7-ylmethanol
SMILESOCC1CCCC12CC2
InChIInChI=1S/C8H14O/c9-6-7-2-1-3-8(7)4-5-8/h7,9H,1-6H2
InChIKeyYYNJVLYECTWIGI-UHFFFAOYSA-N
MW126.20 g/mol
LogP1.56
Rot. Bonds1

About spiro[2.4]heptan-7-ylmethanol

spiro[2.4]heptan-7-ylmethanol (PubChem CID 149455832) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is spiro[2.4]heptan-7-ylmethanol.

Molecular Properties

Compound Namespiro[2.4]heptan-7-ylmethanol
PubChem CID149455832
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Namespiro[2.4]heptan-7-ylmethanol
SMILESOCC1CCCC12CC2
InChIInChI=1S/C8H14O/c9-6-7-2-1-3-8(7)4-5-8/h7,9H,1-6H2
InChIKeyYYNJVLYECTWIGI-UHFFFAOYSA-N
XLogP1.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

8-oxaspiro[4.5]decan-4-ylmethanol
CID 126975254
[(2R)-spiro[2.3]hexan-2-yl]methanol
CID 129372224
[(2R)-spiro[2.5]octan-2-yl]methanol
CID 129372228
[(4S,5S)-6-azaspiro[4.5]decan-4-yl]methanol
CID 131010273
[2-methyl-2-(methylamino)cyclohexyl]methanol;hydrochloride
CID 53396844
2-spiro[2.5]octan-8-ylacetaldehyde
CID 155822522
(8S)-spiro[2.5]octan-8-amine
CID 89147381
(8R)-spiro[2.5]octan-8-amine
CID 89147380
[(1R,2S)-2-amino-2-methylcyclohexyl]methanol;hydrochloride
CID 17039395
[1-(hydroxymethyl)-2-bicyclo[5.2.0]nonanyl]methanol
CID 66908286
N-methyl-1-spiro[4.5]decan-10-ylmethanamine
CID 83906628
[(8S)-6-amino-6-azaspiro[3.4]octan-8-yl]methanol
CID 129496100

Frequently Asked Questions

What is the IUPAC name of spiro[2.4]heptan-7-ylmethanol?
The IUPAC name of spiro[2.4]heptan-7-ylmethanol (CID 149455832) is spiro[2.4]heptan-7-ylmethanol.
What is the SMILES notation for spiro[2.4]heptan-7-ylmethanol?
The canonical SMILES for spiro[2.4]heptan-7-ylmethanol is OCC1CCCC12CC2.
What is the InChIKey of spiro[2.4]heptan-7-ylmethanol?
The InChIKey is YYNJVLYECTWIGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c9-6-7-2-1-3-8(7)4-5-8/h7,9H,1-6H2.
What are the key properties of spiro[2.4]heptan-7-ylmethanol?
spiro[2.4]heptan-7-ylmethanol has a molecular weight of 126.20 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[2.4]heptan-7-ylmethanol is sourced from PubChem (CID 149455832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).