1,3-dimethylpiperidin-4-amine

C7H16N2 — CID 23008883

IUPAC1,3-dimethylpiperidin-4-amine
SMILESCC1CN(C)CCC1N
InChIInChI=1S/C7H16N2/c1-6-5-9(2)4-3-7(6)8/h6-7H,3-5,8H2,1-2H3
InChIKeyWLFDKDVGHUCVFY-UHFFFAOYSA-N
MW128.22 g/mol
LogP0.29
Rot. Bonds

About 1,3-dimethylpiperidin-4-amine

1,3-dimethylpiperidin-4-amine (PubChem CID 23008883) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is 1,3-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1,3-dimethylpiperidin-4-amine
PubChem CID23008883
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name1,3-dimethylpiperidin-4-amine
SMILESCC1CN(C)CCC1N
InChIInChI=1S/C7H16N2/c1-6-5-9(2)4-3-7(6)8/h6-7H,3-5,8H2,1-2H3
InChIKeyWLFDKDVGHUCVFY-UHFFFAOYSA-N
XLogP0.29
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethylpiperidin-4-amine?
The IUPAC name of 1,3-dimethylpiperidin-4-amine (CID 23008883) is 1,3-dimethylpiperidin-4-amine.
What is the SMILES notation for 1,3-dimethylpiperidin-4-amine?
The canonical SMILES for 1,3-dimethylpiperidin-4-amine is CC1CN(C)CCC1N.
What is the InChIKey of 1,3-dimethylpiperidin-4-amine?
The InChIKey is WLFDKDVGHUCVFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2/c1-6-5-9(2)4-3-7(6)8/h6-7H,3-5,8H2,1-2H3.
What are the key properties of 1,3-dimethylpiperidin-4-amine?
1,3-dimethylpiperidin-4-amine has a molecular weight of 128.22 g/mol, XLogP of 0.29, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethylpiperidin-4-amine is sourced from PubChem (CID 23008883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).