2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine

C18H30N2 — CID 83986506

IUPAC2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine
SMILESCCN1CCCCC1C(CN)c1ccc(C(C)C)cc1
InChIInChI=1S/C18H30N2/c1-4-20-12-6-5-7-18(20)17(13-19)16-10-8-15(9-11-16)14(2)3/h8-11,14,17-18H,4-7,12-13,19H2,1-3H3
InChIKeyWXETZQKUMCXYNN-UHFFFAOYSA-N
MW274.45 g/mol
LogP3.73
Rot. Bonds5

About 2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine

2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine (PubChem CID 83986506) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is 2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine.

Molecular Properties

Compound Name2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine
PubChem CID83986506
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC Name2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine
SMILESCCN1CCCCC1C(CN)c1ccc(C(C)C)cc1
InChIInChI=1S/C18H30N2/c1-4-20-12-6-5-7-18(20)17(13-19)16-10-8-15(9-11-16)14(2)3/h8-11,14,17-18H,4-7,12-13,19H2,1-3H3
InChIKeyWXETZQKUMCXYNN-UHFFFAOYSA-N
XLogP3.73
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-amino-1-(1-ethylpiperidin-2-yl)ethyl]phenol
CID 83987243
2-(1,3-benzodioxol-5-yl)-2-(1-ethylpiperidin-2-yl)ethanamine
CID 83986798
4-[2-amino-1-[1-(2-methylpropyl)piperidin-2-yl]ethyl]phenol
CID 83987245
2-(3,4-dichlorophenyl)-2-(1-propylpiperidin-2-yl)ethanamine
CID 83986396
2-cyclopentyl-2-(4-propan-2-ylphenyl)ethanamine
CID 79022519
2-(3,4-difluorophenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine
CID 83986706
2-(3,4-difluorophenyl)-2-(1-propylpiperidin-2-yl)ethanamine
CID 83986705
2-(3,4-dimethoxyphenyl)-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine
CID 83986310
2-cyclopropyl-2-(4-propan-2-ylphenyl)ethanamine
CID 82024028
2-(1,2-dimethylindol-3-yl)-2-(1-ethylpiperidin-2-yl)ethanamine
CID 83987607
2-(4-tert-butylphenyl)-2-(1-methylpiperidin-2-yl)ethanamine
CID 83987713
2-(2-methylpiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine
CID 43180363

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine?
The IUPAC name of 2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine (CID 83986506) is 2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine.
What is the SMILES notation for 2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine?
The canonical SMILES for 2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine is CCN1CCCCC1C(CN)c1ccc(C(C)C)cc1.
What is the InChIKey of 2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine?
The InChIKey is WXETZQKUMCXYNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-4-20-12-6-5-7-18(20)17(13-19)16-10-8-15(9-11-16)14(2)3/h8-11,14,17-18H,4-7,12-13,19H2,1-3H3.
What are the key properties of 2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine?
2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine has a molecular weight of 274.45 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpiperidin-2-yl)-2-(4-propan-2-ylphenyl)ethanamine is sourced from PubChem (CID 83986506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).