3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium

C11H12NRf- — CID 134949989

IUPAC3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium
SMILESCC1[C-]=Nc2ccccc2C1C.[Rf]
InChIInChI=1S/C11H12N.Rf/c1-8-7-12-11-6-4-3-5-10(11)9(8)2;/h3-6,8-9H,1-2H3;/q-1;
InChIKeyUPUDNFMWGXYPMV-UHFFFAOYSA-N
MW425.22 g/mol
LogP3.02
Rot. Bonds

About 3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium

3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium (PubChem CID 134949989) has the molecular formula C11H12NRf- and a molecular weight of 425.22 g/mol. Its IUPAC name is 3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium.

Molecular Properties

Compound Name3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium
PubChem CID134949989
Molecular FormulaC11H12NRf-
Molecular Weight425.22 g/mol
Exact Mass425.22
IUPAC Name3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium
SMILESCC1[C-]=Nc2ccccc2C1C.[Rf]
InChIInChI=1S/C11H12N.Rf/c1-8-7-12-11-6-4-3-5-10(11)9(8)2;/h3-6,8-9H,1-2H3;/q-1;
InChIKeyUPUDNFMWGXYPMV-UHFFFAOYSA-N
XLogP3.02
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.22
LogP ≤ 53.02
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 3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium?
The IUPAC name of 3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium (CID 134949989) is 3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium.
What is the SMILES notation for 3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium?
The canonical SMILES for 3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium is CC1[C-]=Nc2ccccc2C1C.[Rf].
What is the InChIKey of 3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium?
The InChIKey is UPUDNFMWGXYPMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N.Rf/c1-8-7-12-11-6-4-3-5-10(11)9(8)2;/h3-6,8-9H,1-2H3;/q-1;.
What are the key properties of 3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium?
3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium has a molecular weight of 425.22 g/mol, XLogP of 3.02, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-3,4-dihydro-2H-quinolin-2-ide;rutherfordium is sourced from PubChem (CID 134949989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).