deuterium monohydride;formonitrile

CH3N — CID 173074590

IUPACdeuterium monohydride;formonitrile
SMILESC#N.[H][2H]
InChIInChI=1S/CHN.H2/c1-2;/h1H;1H/i;1+1
InChIKeyOUFSSEVWLUPEJV-IEOVAKBOSA-N
MW30.05 g/mol
LogP0.39
Rot. Bonds

About deuterium monohydride;formonitrile

deuterium monohydride;formonitrile (PubChem CID 173074590) has the molecular formula CH3N and a molecular weight of 30.05 g/mol. Its IUPAC name is deuterium monohydride;formonitrile.

Molecular Properties

Compound Namedeuterium monohydride;formonitrile
PubChem CID173074590
Molecular FormulaCH3N
Molecular Weight30.05 g/mol
Exact Mass30.03
IUPAC Namedeuterium monohydride;formonitrile
SMILESC#N.[H][2H]
InChIInChI=1S/CHN.H2/c1-2;/h1H;1H/i;1+1
InChIKeyOUFSSEVWLUPEJV-IEOVAKBOSA-N
XLogP0.39
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms2
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50030.05
LogP ≤ 50.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of deuterium monohydride;formonitrile?
The IUPAC name of deuterium monohydride;formonitrile (CID 173074590) is deuterium monohydride;formonitrile.
What is the SMILES notation for deuterium monohydride;formonitrile?
The canonical SMILES for deuterium monohydride;formonitrile is C#N.[H][2H].
What is the InChIKey of deuterium monohydride;formonitrile?
The InChIKey is OUFSSEVWLUPEJV-IEOVAKBOSA-N. The full InChI is InChI=1S/CHN.H2/c1-2;/h1H;1H/i;1+1.
What are the key properties of deuterium monohydride;formonitrile?
deuterium monohydride;formonitrile has a molecular weight of 30.05 g/mol, XLogP of 0.39, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for deuterium monohydride;formonitrile is sourced from PubChem (CID 173074590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).