2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine

C15H28N2 — CID 112743338

IUPAC2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine
SMILESCC1CCN(C(CN)(C2CC2)C2CC2)CC1C
InChIInChI=1S/C15H28N2/c1-11-7-8-17(9-12(11)2)15(10-16,13-3-4-13)14-5-6-14/h11-14H,3-10,16H2,1-2H3
InChIKeySILPFJDXMSMFFT-UHFFFAOYSA-N
MW236.40 g/mol
LogP2.48
Rot. Bonds4

About 2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine

2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine (PubChem CID 112743338) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is 2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine.

Molecular Properties

Compound Name2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine
PubChem CID112743338
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC Name2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine
SMILESCC1CCN(C(CN)(C2CC2)C2CC2)CC1C
InChIInChI=1S/C15H28N2/c1-11-7-8-17(9-12(11)2)15(10-16,13-3-4-13)14-5-6-14/h11-14H,3-10,16H2,1-2H3
InChIKeySILPFJDXMSMFFT-UHFFFAOYSA-N
XLogP2.48
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine?
The IUPAC name of 2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine (CID 112743338) is 2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine.
What is the SMILES notation for 2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine?
The canonical SMILES for 2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine is CC1CCN(C(CN)(C2CC2)C2CC2)CC1C.
What is the InChIKey of 2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine?
The InChIKey is SILPFJDXMSMFFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2/c1-11-7-8-17(9-12(11)2)15(10-16,13-3-4-13)14-5-6-14/h11-14H,3-10,16H2,1-2H3.
What are the key properties of 2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine?
2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine has a molecular weight of 236.40 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dicyclopropyl-2-(3,4-dimethylpiperidin-1-yl)ethanamine is sourced from PubChem (CID 112743338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).