adamantane;methane;methanol

C12H24O — CID 174446810

IUPACadamantane;methane;methanol
SMILESC.C1C2CC3CC1CC(C2)C3.CO
InChIInChI=1S/C10H16.CH4O.CH4/c1-7-2-9-4-8(1)5-10(3-7)6-9;1-2;/h7-10H,1-6H2;2H,1H3;1H4
InChIKeyAFEYVJJJPTUJPA-UHFFFAOYSA-N
MW184.32 g/mol
LogP3.08
Rot. Bonds

About adamantane;methane;methanol

adamantane;methane;methanol (PubChem CID 174446810) has the molecular formula C12H24O and a molecular weight of 184.32 g/mol. Its IUPAC name is adamantane;methane;methanol.

Molecular Properties

Compound Nameadamantane;methane;methanol
PubChem CID174446810
Molecular FormulaC12H24O
Molecular Weight184.32 g/mol
Exact Mass184.18
IUPAC Nameadamantane;methane;methanol
SMILESC.C1C2CC3CC1CC(C2)C3.CO
InChIInChI=1S/C10H16.CH4O.CH4/c1-7-2-9-4-8(1)5-10(3-7)6-9;1-2;/h7-10H,1-6H2;2H,1H3;1H4
InChIKeyAFEYVJJJPTUJPA-UHFFFAOYSA-N
XLogP3.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.32
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of adamantane;methane;methanol?
The IUPAC name of adamantane;methane;methanol (CID 174446810) is adamantane;methane;methanol.
What is the SMILES notation for adamantane;methane;methanol?
The canonical SMILES for adamantane;methane;methanol is C.C1C2CC3CC1CC(C2)C3.CO.
What is the InChIKey of adamantane;methane;methanol?
The InChIKey is AFEYVJJJPTUJPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16.CH4O.CH4/c1-7-2-9-4-8(1)5-10(3-7)6-9;1-2;/h7-10H,1-6H2;2H,1H3;1H4.
What are the key properties of adamantane;methane;methanol?
adamantane;methane;methanol has a molecular weight of 184.32 g/mol, XLogP of 3.08, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for adamantane;methane;methanol is sourced from PubChem (CID 174446810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).