1,2,2,4,4,5,6-heptamethylpiperidine

C12H25N — CID 23546869

IUPAC1,2,2,4,4,5,6-heptamethylpiperidine
SMILESCC1C(C)C(C)(C)CC(C)(C)N1C
InChIInChI=1S/C12H25N/c1-9-10(2)13(7)12(5,6)8-11(9,3)4/h9-10H,8H2,1-7H3
InChIKeyXGTIAQCAPPFNAV-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.15
Rot. Bonds

About 1,2,2,4,4,5,6-heptamethylpiperidine

1,2,2,4,4,5,6-heptamethylpiperidine (PubChem CID 23546869) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 1,2,2,4,4,5,6-heptamethylpiperidine.

Molecular Properties

Compound Name1,2,2,4,4,5,6-heptamethylpiperidine
PubChem CID23546869
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name1,2,2,4,4,5,6-heptamethylpiperidine
SMILESCC1C(C)C(C)(C)CC(C)(C)N1C
InChIInChI=1S/C12H25N/c1-9-10(2)13(7)12(5,6)8-11(9,3)4/h9-10H,8H2,1-7H3
InChIKeyXGTIAQCAPPFNAV-UHFFFAOYSA-N
XLogP3.15
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,2,2,4,4,5,6-heptamethylpiperidine?
The IUPAC name of 1,2,2,4,4,5,6-heptamethylpiperidine (CID 23546869) is 1,2,2,4,4,5,6-heptamethylpiperidine.
What is the SMILES notation for 1,2,2,4,4,5,6-heptamethylpiperidine?
The canonical SMILES for 1,2,2,4,4,5,6-heptamethylpiperidine is CC1C(C)C(C)(C)CC(C)(C)N1C.
What is the InChIKey of 1,2,2,4,4,5,6-heptamethylpiperidine?
The InChIKey is XGTIAQCAPPFNAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-9-10(2)13(7)12(5,6)8-11(9,3)4/h9-10H,8H2,1-7H3.
What are the key properties of 1,2,2,4,4,5,6-heptamethylpiperidine?
1,2,2,4,4,5,6-heptamethylpiperidine has a molecular weight of 183.34 g/mol, XLogP of 3.15, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,4,4,5,6-heptamethylpiperidine is sourced from PubChem (CID 23546869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).