deuterium monohydride;methane

C5H22 — CID 157066604

IUPACdeuterium monohydride;methane
SMILESC.C.C.C.C.[H][2H]
InChIInChI=1S/5CH4.H2/h5*1H4;1H/i;;;;;1+1
InChIKeyABYGHFXDZANPSP-PUQAOBSFSA-N
MW83.24 g/mol
LogP3.43
Rot. Bonds

About deuterium monohydride;methane

deuterium monohydride;methane (PubChem CID 157066604) has the molecular formula C5H22 and a molecular weight of 83.24 g/mol. Its IUPAC name is deuterium monohydride;methane.

Molecular Properties

Compound Namedeuterium monohydride;methane
PubChem CID157066604
Molecular FormulaC5H22
Molecular Weight83.24 g/mol
Exact Mass83.18
IUPAC Namedeuterium monohydride;methane
SMILESC.C.C.C.C.[H][2H]
InChIInChI=1S/5CH4.H2/h5*1H4;1H/i;;;;;1+1
InChIKeyABYGHFXDZANPSP-PUQAOBSFSA-N
XLogP3.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50083.24
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze deuterium monohydride;methane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of deuterium monohydride;methane?
The IUPAC name of deuterium monohydride;methane (CID 157066604) is deuterium monohydride;methane.
What is the SMILES notation for deuterium monohydride;methane?
The canonical SMILES for deuterium monohydride;methane is C.C.C.C.C.[H][2H].
What is the InChIKey of deuterium monohydride;methane?
The InChIKey is ABYGHFXDZANPSP-PUQAOBSFSA-N. The full InChI is InChI=1S/5CH4.H2/h5*1H4;1H/i;;;;;1+1.
What are the key properties of deuterium monohydride;methane?
deuterium monohydride;methane has a molecular weight of 83.24 g/mol, XLogP of 3.43, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for deuterium monohydride;methane is sourced from PubChem (CID 157066604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).