2-(methanidylamino)-4-methylpentanenitrile;uranium

C7H13N2U- — CID 155743178

IUPAC2-(methanidylamino)-4-methylpentanenitrile;uranium
SMILES[CH2-]NC(C#N)CC(C)C.[U]
InChIInChI=1S/C7H13N2.U/c1-6(2)4-7(5-8)9-3;/h6-7,9H,3-4H2,1-2H3;/q-1;
InChIKeyGBASMUVKGDVTQX-UHFFFAOYSA-N
MW363.22 g/mol
LogP1.31
Rot. Bonds3

About 2-(methanidylamino)-4-methylpentanenitrile;uranium

2-(methanidylamino)-4-methylpentanenitrile;uranium (PubChem CID 155743178) has the molecular formula C7H13N2U- and a molecular weight of 363.22 g/mol. Its IUPAC name is 2-(methanidylamino)-4-methylpentanenitrile;uranium.

Molecular Properties

Compound Name2-(methanidylamino)-4-methylpentanenitrile;uranium
PubChem CID155743178
Molecular FormulaC7H13N2U-
Molecular Weight363.22 g/mol
Exact Mass363.16
IUPAC Name2-(methanidylamino)-4-methylpentanenitrile;uranium
SMILES[CH2-]NC(C#N)CC(C)C.[U]
InChIInChI=1S/C7H13N2.U/c1-6(2)4-7(5-8)9-3;/h6-7,9H,3-4H2,1-2H3;/q-1;
InChIKeyGBASMUVKGDVTQX-UHFFFAOYSA-N
XLogP1.31
TPSA35.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.22
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(methanidylamino)-4-methylpentanenitrile;uranium?
The IUPAC name of 2-(methanidylamino)-4-methylpentanenitrile;uranium (CID 155743178) is 2-(methanidylamino)-4-methylpentanenitrile;uranium.
What is the SMILES notation for 2-(methanidylamino)-4-methylpentanenitrile;uranium?
The canonical SMILES for 2-(methanidylamino)-4-methylpentanenitrile;uranium is [CH2-]NC(C#N)CC(C)C.[U].
What is the InChIKey of 2-(methanidylamino)-4-methylpentanenitrile;uranium?
The InChIKey is GBASMUVKGDVTQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N2.U/c1-6(2)4-7(5-8)9-3;/h6-7,9H,3-4H2,1-2H3;/q-1;.
What are the key properties of 2-(methanidylamino)-4-methylpentanenitrile;uranium?
2-(methanidylamino)-4-methylpentanenitrile;uranium has a molecular weight of 363.22 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methanidylamino)-4-methylpentanenitrile;uranium is sourced from PubChem (CID 155743178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).