adamantane;methane

C11H20 — CID 18954917

IUPACadamantane;methane
SMILESC.C1C2CC3CC1CC(C2)C3
InChIInChI=1S/C10H16.CH4/c1-7-2-9-4-8(1)5-10(3-7)6-9;/h7-10H,1-6H2;1H4
InChIKeyBNRMADCKLGLBGH-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.47
Rot. Bonds

About adamantane;methane

adamantane;methane (PubChem CID 18954917) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is adamantane;methane.

Molecular Properties

Compound Nameadamantane;methane
PubChem CID18954917
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Nameadamantane;methane
SMILESC.C1C2CC3CC1CC(C2)C3
InChIInChI=1S/C10H16.CH4/c1-7-2-9-4-8(1)5-10(3-7)6-9;/h7-10H,1-6H2;1H4
InChIKeyBNRMADCKLGLBGH-UHFFFAOYSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of adamantane;methane?
The IUPAC name of adamantane;methane (CID 18954917) is adamantane;methane.
What is the SMILES notation for adamantane;methane?
The canonical SMILES for adamantane;methane is C.C1C2CC3CC1CC(C2)C3.
What is the InChIKey of adamantane;methane?
The InChIKey is BNRMADCKLGLBGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16.CH4/c1-7-2-9-4-8(1)5-10(3-7)6-9;/h7-10H,1-6H2;1H4.
What are the key properties of adamantane;methane?
adamantane;methane has a molecular weight of 152.28 g/mol, XLogP of 3.47, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for adamantane;methane is sourced from PubChem (CID 18954917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).