3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium

C8H16NRe- — CID 171658485

IUPAC3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium
SMILESCC(C)C1(C)CC[N-]C1.[Re]
InChIInChI=1S/C8H16N.Re/c1-7(2)8(3)4-5-9-6-8;/h7H,4-6H2,1-3H3;/q-1;
InChIKeyCQZQDRXBTTXLSC-UHFFFAOYSA-N
MW312.43 g/mol
LogP2.42
Rot. Bonds1

About 3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium

3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium (PubChem CID 171658485) has the molecular formula C8H16NRe- and a molecular weight of 312.43 g/mol. Its IUPAC name is 3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium.

Molecular Properties

Compound Name3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium
PubChem CID171658485
Molecular FormulaC8H16NRe-
Molecular Weight312.43 g/mol
Exact Mass313.08
IUPAC Name3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium
SMILESCC(C)C1(C)CC[N-]C1.[Re]
InChIInChI=1S/C8H16N.Re/c1-7(2)8(3)4-5-9-6-8;/h7H,4-6H2,1-3H3;/q-1;
InChIKeyCQZQDRXBTTXLSC-UHFFFAOYSA-N
XLogP2.42
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.43
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium?
The IUPAC name of 3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium (CID 171658485) is 3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium.
What is the SMILES notation for 3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium?
The canonical SMILES for 3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium is CC(C)C1(C)CC[N-]C1.[Re].
What is the InChIKey of 3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium?
The InChIKey is CQZQDRXBTTXLSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N.Re/c1-7(2)8(3)4-5-9-6-8;/h7H,4-6H2,1-3H3;/q-1;.
What are the key properties of 3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium?
3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium has a molecular weight of 312.43 g/mol, XLogP of 2.42, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-propan-2-ylpyrrolidin-1-ide;rhenium is sourced from PubChem (CID 171658485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).