3-methyl-1-(2,2,4-trimethylpentyl)piperidine

C14H29N — CID 118299028

IUPAC3-methyl-1-(2,2,4-trimethylpentyl)piperidine
SMILESCC(C)CC(C)(C)CN1CCCC(C)C1
InChIInChI=1S/C14H29N/c1-12(2)9-14(4,5)11-15-8-6-7-13(3)10-15/h12-13H,6-11H2,1-5H3
InChIKeyFAAJZMZSBXWHCU-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.79
Rot. Bonds4

About 3-methyl-1-(2,2,4-trimethylpentyl)piperidine

3-methyl-1-(2,2,4-trimethylpentyl)piperidine (PubChem CID 118299028) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 3-methyl-1-(2,2,4-trimethylpentyl)piperidine.

Molecular Properties

Compound Name3-methyl-1-(2,2,4-trimethylpentyl)piperidine
PubChem CID118299028
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name3-methyl-1-(2,2,4-trimethylpentyl)piperidine
SMILESCC(C)CC(C)(C)CN1CCCC(C)C1
InChIInChI=1S/C14H29N/c1-12(2)9-14(4,5)11-15-8-6-7-13(3)10-15/h12-13H,6-11H2,1-5H3
InChIKeyFAAJZMZSBXWHCU-UHFFFAOYSA-N
XLogP3.79
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(2,2,4-trimethylpentyl)piperidine?
The IUPAC name of 3-methyl-1-(2,2,4-trimethylpentyl)piperidine (CID 118299028) is 3-methyl-1-(2,2,4-trimethylpentyl)piperidine.
What is the SMILES notation for 3-methyl-1-(2,2,4-trimethylpentyl)piperidine?
The canonical SMILES for 3-methyl-1-(2,2,4-trimethylpentyl)piperidine is CC(C)CC(C)(C)CN1CCCC(C)C1.
What is the InChIKey of 3-methyl-1-(2,2,4-trimethylpentyl)piperidine?
The InChIKey is FAAJZMZSBXWHCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-12(2)9-14(4,5)11-15-8-6-7-13(3)10-15/h12-13H,6-11H2,1-5H3.
What are the key properties of 3-methyl-1-(2,2,4-trimethylpentyl)piperidine?
3-methyl-1-(2,2,4-trimethylpentyl)piperidine has a molecular weight of 211.39 g/mol, XLogP of 3.79, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(2,2,4-trimethylpentyl)piperidine is sourced from PubChem (CID 118299028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).