6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine

C13H28N2 — CID 106799729

IUPAC6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine
SMILESCCC(N)CCCN1CCC(C)CC1C
InChIInChI=1S/C13H28N2/c1-4-13(14)6-5-8-15-9-7-11(2)10-12(15)3/h11-13H,4-10,14H2,1-3H3
InChIKeyHHSNBLJKHTYZAL-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.62
Rot. Bonds5

About 6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine

6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine (PubChem CID 106799729) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine.

Molecular Properties

Compound Name6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine
PubChem CID106799729
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine
SMILESCCC(N)CCCN1CCC(C)CC1C
InChIInChI=1S/C13H28N2/c1-4-13(14)6-5-8-15-9-7-11(2)10-12(15)3/h11-13H,4-10,14H2,1-3H3
InChIKeyHHSNBLJKHTYZAL-UHFFFAOYSA-N
XLogP2.62
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine?
The IUPAC name of 6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine (CID 106799729) is 6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine.
What is the SMILES notation for 6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine?
The canonical SMILES for 6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine is CCC(N)CCCN1CCC(C)CC1C.
What is the InChIKey of 6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine?
The InChIKey is HHSNBLJKHTYZAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-4-13(14)6-5-8-15-9-7-11(2)10-12(15)3/h11-13H,4-10,14H2,1-3H3.
What are the key properties of 6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine?
6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine has a molecular weight of 212.38 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dimethylpiperidin-1-yl)hexan-3-amine is sourced from PubChem (CID 106799729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).