3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine

C13H28N2 — CID 62257220

IUPAC3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine
SMILESCNCC(C)(C)CN1CCCC(C)C1C
InChIInChI=1S/C13H28N2/c1-11-7-6-8-15(12(11)2)10-13(3,4)9-14-5/h11-12,14H,6-10H2,1-5H3
InChIKeyRSMWVWFRLDZDHN-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.35
Rot. Bonds4

About 3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine

3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine (PubChem CID 62257220) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine.

Molecular Properties

Compound Name3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine
PubChem CID62257220
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine
SMILESCNCC(C)(C)CN1CCCC(C)C1C
InChIInChI=1S/C13H28N2/c1-11-7-6-8-15(12(11)2)10-13(3,4)9-14-5/h11-12,14H,6-10H2,1-5H3
InChIKeyRSMWVWFRLDZDHN-UHFFFAOYSA-N
XLogP2.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine?
The IUPAC name of 3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine (CID 62257220) is 3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine.
What is the SMILES notation for 3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine?
The canonical SMILES for 3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine is CNCC(C)(C)CN1CCCC(C)C1C.
What is the InChIKey of 3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine?
The InChIKey is RSMWVWFRLDZDHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-11-7-6-8-15(12(11)2)10-13(3,4)9-14-5/h11-12,14H,6-10H2,1-5H3.
What are the key properties of 3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine?
3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine has a molecular weight of 212.38 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dimethylpiperidin-1-yl)-N,2,2-trimethylpropan-1-amine is sourced from PubChem (CID 62257220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).