actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide]

C14H17AcN2- — CID 20741308

IUPACactinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide]
SMILESCC1=CC2(CC[N-]CC2)Nc2ccccc21.[Ac]
InChIInChI=1S/C14H17N2.Ac/c1-11-10-14(6-8-15-9-7-14)16-13-5-3-2-4-12(11)13;/h2-5,10,16H,6-9H2,1H3;/q-1;
InChIKeyCNCYXUFNCRZLQB-UHFFFAOYSA-N
MW440.30 g/mol
LogP3.42
Rot. Bonds

About actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide]

actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide] (PubChem CID 20741308) has the molecular formula C14H17AcN2- and a molecular weight of 440.30 g/mol. Its IUPAC name is actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide].

Molecular Properties

Compound Nameactinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide]
PubChem CID20741308
Molecular FormulaC14H17AcN2-
Molecular Weight440.30 g/mol
Exact Mass440.17
IUPAC Nameactinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide]
SMILESCC1=CC2(CC[N-]CC2)Nc2ccccc21.[Ac]
InChIInChI=1S/C14H17N2.Ac/c1-11-10-14(6-8-15-9-7-14)16-13-5-3-2-4-12(11)13;/h2-5,10,16H,6-9H2,1H3;/q-1;
InChIKeyCNCYXUFNCRZLQB-UHFFFAOYSA-N
XLogP3.42
TPSA26.13 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.30
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide]?
The IUPAC name of actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide] (CID 20741308) is actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide].
What is the SMILES notation for actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide]?
The canonical SMILES for actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide] is CC1=CC2(CC[N-]CC2)Nc2ccccc21.[Ac].
What is the InChIKey of actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide]?
The InChIKey is CNCYXUFNCRZLQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N2.Ac/c1-11-10-14(6-8-15-9-7-14)16-13-5-3-2-4-12(11)13;/h2-5,10,16H,6-9H2,1H3;/q-1;.
What are the key properties of actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide]?
actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide] has a molecular weight of 440.30 g/mol, XLogP of 3.42, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for actinium;4-methylspiro[1H-quinoline-2,4'-piperidin-1-ide] is sourced from PubChem (CID 20741308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).