2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine

C14H24N2O — CID 55163205

IUPAC2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine
SMILESCCC1(C)CCN(C(CN)c2ccoc2)CC1
InChIInChI=1S/C14H24N2O/c1-3-14(2)5-7-16(8-6-14)13(10-15)12-4-9-17-11-12/h4,9,11,13H,3,5-8,10,15H2,1-2H3
InChIKeySCQZMDPZVRGYEE-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.79
Rot. Bonds4

About 2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine

2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine (PubChem CID 55163205) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine
PubChem CID55163205
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine
SMILESCCC1(C)CCN(C(CN)c2ccoc2)CC1
InChIInChI=1S/C14H24N2O/c1-3-14(2)5-7-16(8-6-14)13(10-15)12-4-9-17-11-12/h4,9,11,13H,3,5-8,10,15H2,1-2H3
InChIKeySCQZMDPZVRGYEE-UHFFFAOYSA-N
XLogP2.79
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethyl-4-methylpiperidin-1-yl)-2-(4-fluorophenyl)ethanamine
CID 63156191
4-[2-amino-1-(4-ethyl-4-methylpiperidin-1-yl)ethyl]-N,N-dimethylaniline
CID 63157411
2-(4-ethyl-4-methylpiperidin-1-yl)-2-(3-fluorophenyl)ethanamine
CID 63156587
2-(3-chloro-4-methylphenyl)-2-(4-ethyl-4-methylpiperidin-1-yl)ethanamine
CID 106817408
2-(3-bromo-4-fluorophenyl)-2-(4-ethyl-4-methylpiperidin-1-yl)ethanamine
CID 63157455
2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine
CID 63208703
2-(furan-3-yl)-2-(3,4,5-trimethylpiperazin-1-yl)ethanamine
CID 114537409
2-(4-cyclopentylpiperazin-1-yl)-2-(furan-3-yl)ethanamine
CID 55163009
2-(2-chloro-6-fluorophenyl)-2-(4-ethyl-4-methylpiperidin-1-yl)ethanamine
CID 63157457
2-(4-ethyl-4-methylpiperidin-1-yl)propan-1-amine
CID 63157136
2-(4-bromo-5-chlorothiophen-2-yl)-2-(4-ethyl-4-methylpiperidin-1-yl)ethanamine
CID 102839181
2-(4-ethyl-4-methylpiperidin-1-yl)-4-phenylpentan-1-amine
CID 63157326

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine?
The IUPAC name of 2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine (CID 55163205) is 2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine.
What is the SMILES notation for 2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine?
The canonical SMILES for 2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine is CCC1(C)CCN(C(CN)c2ccoc2)CC1.
What is the InChIKey of 2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine?
The InChIKey is SCQZMDPZVRGYEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-3-14(2)5-7-16(8-6-14)13(10-15)12-4-9-17-11-12/h4,9,11,13H,3,5-8,10,15H2,1-2H3.
What are the key properties of 2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine?
2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine has a molecular weight of 236.36 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine is sourced from PubChem (CID 55163205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).