3,5-dimethylpiperidin-4-amine

C7H16N2 — CID 10171243

IUPAC3,5-dimethylpiperidin-4-amine
SMILESCC1CNCC(C)C1N
InChIInChI=1S/C7H16N2/c1-5-3-9-4-6(2)7(5)8/h5-7,9H,3-4,8H2,1-2H3
InChIKeyXJSUUJDMFDMIGK-UHFFFAOYSA-N
MW128.22 g/mol
LogP0.19
Rot. Bonds

About 3,5-dimethylpiperidin-4-amine

3,5-dimethylpiperidin-4-amine (PubChem CID 10171243) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is 3,5-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name3,5-dimethylpiperidin-4-amine
PubChem CID10171243
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name3,5-dimethylpiperidin-4-amine
SMILESCC1CNCC(C)C1N
InChIInChI=1S/C7H16N2/c1-5-3-9-4-6(2)7(5)8/h5-7,9H,3-4,8H2,1-2H3
InChIKeyXJSUUJDMFDMIGK-UHFFFAOYSA-N
XLogP0.19
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3R,4S)-4-methylpyrrolidin-3-amine;dihydrochloride
CID 25178690
(1R,5S)-7-methyl-3-azabicyclo[3.1.1]heptan-6-amine
CID 131858389
3,5-dimethylpiperidin-4-ol;ethane
CID 176666809
(3S,4S)-3-fluoro-4-methylpyrrolidine
CID 118447015
3-methylpiperidin-4-amine;dihydrochloride
CID 155921065
ethane;(4S)-3-fluoro-4-methylpyrrolidine
CID 177212529
acetaldehyde;(3S,4R)-3,4-dimethylpyrrolidine;ethane
CID 143696476
(3R,4R)-4-methylpyrrolidin-3-ol;hydrochloride
CID 67314821
ethane;3-fluoro-4-methylpyrrolidine
CID 144862770
ethane;3-methylazetidine
CID 90730870
2,6,7-trimethyl-1,4-diazepane
CID 134277914
(3R,5S)-5-methylpiperidin-3-amine
CID 90290401

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethylpiperidin-4-amine?
The IUPAC name of 3,5-dimethylpiperidin-4-amine (CID 10171243) is 3,5-dimethylpiperidin-4-amine.
What is the SMILES notation for 3,5-dimethylpiperidin-4-amine?
The canonical SMILES for 3,5-dimethylpiperidin-4-amine is CC1CNCC(C)C1N.
What is the InChIKey of 3,5-dimethylpiperidin-4-amine?
The InChIKey is XJSUUJDMFDMIGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2/c1-5-3-9-4-6(2)7(5)8/h5-7,9H,3-4,8H2,1-2H3.
What are the key properties of 3,5-dimethylpiperidin-4-amine?
3,5-dimethylpiperidin-4-amine has a molecular weight of 128.22 g/mol, XLogP of 0.19, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethylpiperidin-4-amine is sourced from PubChem (CID 10171243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).