2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine

C13H28N2 — CID 63156831

IUPAC2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine
SMILESCCC1(C)CCN(C(CN)C(C)C)CC1
InChIInChI=1S/C13H28N2/c1-5-13(4)6-8-15(9-7-13)12(10-14)11(2)3/h11-12H,5-10,14H2,1-4H3
InChIKeyLCHLSWNCILJIJD-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.48
Rot. Bonds4

About 2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine

2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine (PubChem CID 63156831) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine.

Molecular Properties

Compound Name2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine
PubChem CID63156831
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine
SMILESCCC1(C)CCN(C(CN)C(C)C)CC1
InChIInChI=1S/C13H28N2/c1-5-13(4)6-8-15(9-7-13)12(10-14)11(2)3/h11-12H,5-10,14H2,1-4H3
InChIKeyLCHLSWNCILJIJD-UHFFFAOYSA-N
XLogP2.48
TPSA29.26 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 ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-ethyl-4-methylpiperidin-1-yl)propan-1-amine
CID 63157136
2-(8-azaspiro[4.5]decan-8-yl)-3-methylbutan-1-amine
CID 63157149
(2S)-3-methyl-2-pyrrolidin-1-ylbutan-1-amine
CID 51624584
1-but-3-en-2-yl-4-ethyl-4-methylpiperidine
CID 130841239
3-amino-2-(4-ethyl-4-methylpiperidin-1-yl)pentan-1-ol
CID 104840431
2-(4-ethyl-4-methylpiperidin-1-yl)propanethioamide
CID 63160702
(2S)-3-methyl-2-morpholin-4-ylbutan-1-amine
CID 51624538
2-(4-ethyl-4-methylpiperidin-1-yl)-4-phenylpentan-1-amine
CID 63157326
1-(1-amino-3-methylbutan-2-yl)piperidin-4-ol
CID 82405643
2-(4-ethyl-4-methylpiperidin-1-yl)-2-(4-fluorophenyl)ethanamine
CID 63156191
2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine
CID 55163205
(4-ethyl-4-methylpiperidin-1-yl)phosphane
CID 89203637

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine?
The IUPAC name of 2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine (CID 63156831) is 2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine.
What is the SMILES notation for 2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine?
The canonical SMILES for 2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine is CCC1(C)CCN(C(CN)C(C)C)CC1.
What is the InChIKey of 2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine?
The InChIKey is LCHLSWNCILJIJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-13(4)6-8-15(9-7-13)12(10-14)11(2)3/h11-12H,5-10,14H2,1-4H3.
What are the key properties of 2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine?
2-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine has a molecular weight of 212.38 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-(4-ethyl-4-methylpiperidin-1-yl)-3-methylbutan-1-amine is sourced from PubChem (CID 63156831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).