N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine

C15H32N2 — CID 63163502

IUPACN-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine
SMILESCCC1(C)CCN(CCNC(C)(C)CC)CC1
InChIInChI=1S/C15H32N2/c1-6-14(3,4)16-10-13-17-11-8-15(5,7-2)9-12-17/h16H,6-13H2,1-5H3
InChIKeyLBBVNIQLMDMFGL-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.28
Rot. Bonds6

About N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine

N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine (PubChem CID 63163502) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine.

Molecular Properties

Compound NameN-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine
PubChem CID63163502
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine
SMILESCCC1(C)CCN(CCNC(C)(C)CC)CC1
InChIInChI=1S/C15H32N2/c1-6-14(3,4)16-10-13-17-11-8-15(5,7-2)9-12-17/h16H,6-13H2,1-5H3
InChIKeyLBBVNIQLMDMFGL-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine?
The IUPAC name of N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine (CID 63163502) is N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine.
What is the SMILES notation for N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine?
The canonical SMILES for N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine is CCC1(C)CCN(CCNC(C)(C)CC)CC1.
What is the InChIKey of N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine?
The InChIKey is LBBVNIQLMDMFGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-6-14(3,4)16-10-13-17-11-8-15(5,7-2)9-12-17/h16H,6-13H2,1-5H3.
What are the key properties of N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine?
N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine has a molecular weight of 240.43 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-2-methylbutan-2-amine is sourced from PubChem (CID 63163502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).