CID 11974164

C15H20AuClN2 — CID 11974164

IUPAC—
SMILESCCCN1[C]N(c2c(C)cc(C)cc2C)C=C1.Cl[Au]
InChIInChI=1S/C15H20N2.Au.ClH/c1-5-6-16-7-8-17(11-16)15-13(3)9-12(2)10-14(15)4;;/h7-10H,5-6H2,1-4H3;;1H/q;+1;/p-1
InChIKeyOZLHYKVIFLUMAI-UHFFFAOYSA-M
MW460.76 g/mol
LogP4.30
Rot. Bonds3

About CID 11974164

CID 11974164 (PubChem CID 11974164) has the molecular formula C15H20AuClN2 and a molecular weight of 460.76 g/mol.

Molecular Properties

Compound NameCID 11974164
PubChem CID11974164
Molecular FormulaC15H20AuClN2
Molecular Weight460.76 g/mol
Exact Mass460.10
IUPAC Name—
SMILESCCCN1[C]N(c2c(C)cc(C)cc2C)C=C1.Cl[Au]
InChIInChI=1S/C15H20N2.Au.ClH/c1-5-6-16-7-8-17(11-16)15-13(3)9-12(2)10-14(15)4;;/h7-10H,5-6H2,1-4H3;;1H/q;+1;/p-1
InChIKeyOZLHYKVIFLUMAI-UHFFFAOYSA-M
XLogP4.30
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.76
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 11974164?
The IUPAC name of CID 11974164 (CID 11974164) is not available.
What is the SMILES notation for CID 11974164?
The canonical SMILES for CID 11974164 is CCCN1[C]N(c2c(C)cc(C)cc2C)C=C1.Cl[Au].
What is the InChIKey of CID 11974164?
The InChIKey is OZLHYKVIFLUMAI-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H20N2.Au.ClH/c1-5-6-16-7-8-17(11-16)15-13(3)9-12(2)10-14(15)4;;/h7-10H,5-6H2,1-4H3;;1H/q;+1;/p-1.
What are the key properties of CID 11974164?
CID 11974164 has a molecular weight of 460.76 g/mol, XLogP of 4.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11974164 is sourced from PubChem (CID 11974164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).