[2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol

C16H26O — CID 79550553

IUPAC[2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol
SMILESOCC1(CC2CC3CCC2C3)CC2CCC1C2
InChIInChI=1S/C16H26O/c17-10-16(8-12-2-4-15(16)7-12)9-14-6-11-1-3-13(14)5-11/h11-15,17H,1-10H2
InChIKeyIMWPTYDOMOKXRN-UHFFFAOYSA-N
MW234.38 g/mol
LogP3.61
Rot. Bonds3

About [2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol

[2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol (PubChem CID 79550553) has the molecular formula C16H26O and a molecular weight of 234.38 g/mol. Its IUPAC name is [2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol.

Molecular Properties

Compound Name[2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol
PubChem CID79550553
Molecular FormulaC16H26O
Molecular Weight234.38 g/mol
Exact Mass234.20
IUPAC Name[2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol
SMILESOCC1(CC2CC3CCC2C3)CC2CCC1C2
InChIInChI=1S/C16H26O/c17-10-16(8-12-2-4-15(16)7-12)9-14-6-11-1-3-13(14)5-11/h11-15,17H,1-10H2
InChIKeyIMWPTYDOMOKXRN-UHFFFAOYSA-N
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.38
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol with MolForge

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Related Compounds

2-(2-bicyclo[2.2.1]heptanylmethyl)-2-methylbicyclo[2.2.1]heptane
CID 19890420
[2-(aminomethyl)-2-bicyclo[2.2.1]heptanyl]methanamine
CID 54205638
2-[(1S,4R)-2-bicyclo[2.2.1]heptanyl]ethanol
CID 14043124
3-(2-bicyclo[2.2.1]heptanylmethyl)azetidine-3-carboxylic acid
CID 130806394
[2-(2-butoxyethyl)-2-bicyclo[2.2.1]heptanyl]methanol
CID 66025394
1-(2-bicyclo[2.2.1]heptanylmethyl)-3,4-dimethylcyclohexan-1-ol
CID 79559177
3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol
CID 116540023
(1S,2S,4R)-2-[2-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]bicyclo[2.2.1]heptane
CID 54589598
[2-(furan-2-ylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol
CID 66024942
2-[(1S,4R)-2-bicyclo[2.2.1]heptanyl]acetic acid
CID 11457802
[8-(hydroxymethyl)-4-bicyclo[5.2.1]decanyl]methanol
CID 66848084
(1R,2S,4R)-2-(iodomethyl)bicyclo[2.2.1]heptane
CID 98085317

Frequently Asked Questions

What is the IUPAC name of [2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol?
The IUPAC name of [2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol (CID 79550553) is [2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol.
What is the SMILES notation for [2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol?
The canonical SMILES for [2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol is OCC1(CC2CC3CCC2C3)CC2CCC1C2.
What is the InChIKey of [2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol?
The InChIKey is IMWPTYDOMOKXRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26O/c17-10-16(8-12-2-4-15(16)7-12)9-14-6-11-1-3-13(14)5-11/h11-15,17H,1-10H2.
What are the key properties of [2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol?
[2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol has a molecular weight of 234.38 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol is sourced from PubChem (CID 79550553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).