2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline

C18H30N2 — CID 60924899

IUPAC2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline
SMILESCCc1cccc(C)c1NC(C)C1CCN(CC)CC1
InChIInChI=1S/C18H30N2/c1-5-16-9-7-8-14(3)18(16)19-15(4)17-10-12-20(6-2)13-11-17/h7-9,15,17,19H,5-6,10-13H2,1-4H3
InChIKeyGQUAMCSSQGSLGN-UHFFFAOYSA-N
MW274.45 g/mol
LogP4.09
Rot. Bonds5

About 2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline

2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline (PubChem CID 60924899) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is 2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline.

Molecular Properties

Compound Name2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline
PubChem CID60924899
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC Name2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline
SMILESCCc1cccc(C)c1NC(C)C1CCN(CC)CC1
InChIInChI=1S/C18H30N2/c1-5-16-9-7-8-14(3)18(16)19-15(4)17-10-12-20(6-2)13-11-17/h7-9,15,17,19H,5-6,10-13H2,1-4H3
InChIKeyGQUAMCSSQGSLGN-UHFFFAOYSA-N
XLogP4.09
TPSA15.27 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 ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-6-methyl-N-[1-(1-methylpiperidin-4-yl)ethyl]aniline
CID 54862093
N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline
CID 63448490
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,6-difluoroaniline
CID 43308670
2,6-dichloro-N-[1-(1-ethylpiperidin-4-yl)ethyl]aniline
CID 65469902
3-[1-(1-ethylpiperidin-4-yl)ethylamino]phenol
CID 43308530
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline
CID 43307344
N-[cyclopropyl-(4-fluorophenyl)methyl]-2-ethyl-6-methylaniline
CID 63448207
N-[1-(1-ethylpiperidin-4-yl)ethyl]-5-fluoro-2-methylaniline
CID 43307958
1-(1-ethylpiperidin-4-yl)-N-[(1S)-1-(3-methylphenyl)ethyl]ethanamine
CID 81363743
2,6-dichloro-N-[1-(1-propylpiperidin-4-yl)ethyl]aniline
CID 65467589
N-(2-ethyl-6-methylphenyl)-3-(4-methylpiperidin-1-yl)propanamide
CID 109014562
N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-methylsulfanylaniline
CID 43307452

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline?
The IUPAC name of 2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline (CID 60924899) is 2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline.
What is the SMILES notation for 2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline?
The canonical SMILES for 2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline is CCc1cccc(C)c1NC(C)C1CCN(CC)CC1.
What is the InChIKey of 2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline?
The InChIKey is GQUAMCSSQGSLGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-5-16-9-7-8-14(3)18(16)19-15(4)17-10-12-20(6-2)13-11-17/h7-9,15,17,19H,5-6,10-13H2,1-4H3.
What are the key properties of 2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline?
2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline has a molecular weight of 274.45 g/mol, XLogP of 4.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline is sourced from PubChem (CID 60924899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).