1-propan-2-ylpiperidin-5-ide;vanadium

C8H16NV- — CID 166117378

IUPAC1-propan-2-ylpiperidin-5-ide;vanadium
SMILESCC(C)N1C[CH-]CCC1.[V]
InChIInChI=1S/C8H16N.V/c1-8(2)9-6-4-3-5-7-9;/h4,8H,3,5-7H2,1-2H3;/q-1;
InChIKeyCAJLQGLTSQFYFW-UHFFFAOYSA-N
MW177.17 g/mol
LogP1.69
Rot. Bonds1

About 1-propan-2-ylpiperidin-5-ide;vanadium

1-propan-2-ylpiperidin-5-ide;vanadium (PubChem CID 166117378) has the molecular formula C8H16NV- and a molecular weight of 177.17 g/mol. Its IUPAC name is 1-propan-2-ylpiperidin-5-ide;vanadium.

Molecular Properties

Compound Name1-propan-2-ylpiperidin-5-ide;vanadium
PubChem CID166117378
Molecular FormulaC8H16NV-
Molecular Weight177.17 g/mol
Exact Mass177.07
IUPAC Name1-propan-2-ylpiperidin-5-ide;vanadium
SMILESCC(C)N1C[CH-]CCC1.[V]
InChIInChI=1S/C8H16N.V/c1-8(2)9-6-4-3-5-7-9;/h4,8H,3,5-7H2,1-2H3;/q-1;
InChIKeyCAJLQGLTSQFYFW-UHFFFAOYSA-N
XLogP1.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.17
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1-propan-2-ylpiperidin-5-ide;vanadium?
The IUPAC name of 1-propan-2-ylpiperidin-5-ide;vanadium (CID 166117378) is 1-propan-2-ylpiperidin-5-ide;vanadium.
What is the SMILES notation for 1-propan-2-ylpiperidin-5-ide;vanadium?
The canonical SMILES for 1-propan-2-ylpiperidin-5-ide;vanadium is CC(C)N1C[CH-]CCC1.[V].
What is the InChIKey of 1-propan-2-ylpiperidin-5-ide;vanadium?
The InChIKey is CAJLQGLTSQFYFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N.V/c1-8(2)9-6-4-3-5-7-9;/h4,8H,3,5-7H2,1-2H3;/q-1;.
What are the key properties of 1-propan-2-ylpiperidin-5-ide;vanadium?
1-propan-2-ylpiperidin-5-ide;vanadium has a molecular weight of 177.17 g/mol, XLogP of 1.69, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-ylpiperidin-5-ide;vanadium is sourced from PubChem (CID 166117378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).