N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline

C17H28N2 — CID 43307344

IUPACN-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline
SMILESCCN1CCC(C(C)Nc2ccc(C)cc2C)CC1
InChIInChI=1S/C17H28N2/c1-5-19-10-8-16(9-11-19)15(4)18-17-7-6-13(2)12-14(17)3/h6-7,12,15-16,18H,5,8-11H2,1-4H3
InChIKeyCRJLDEFLDXSWNP-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.84
Rot. Bonds4

About N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline

N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline (PubChem CID 43307344) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline.

Molecular Properties

Compound NameN-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline
PubChem CID43307344
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC NameN-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline
SMILESCCN1CCC(C(C)Nc2ccc(C)cc2C)CC1
InChIInChI=1S/C17H28N2/c1-5-19-10-8-16(9-11-19)15(4)18-17-7-6-13(2)12-14(17)3/h6-7,12,15-16,18H,5,8-11H2,1-4H3
InChIKeyCRJLDEFLDXSWNP-UHFFFAOYSA-N
XLogP3.84
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-fluoro-4-methylaniline
CID 43308622
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxy-5-methylaniline
CID 43307758
N-(1-cyclohexylethyl)-2,4-dimethylaniline
CID 43755727
N-[1-(1-ethylpiperidin-4-yl)ethyl]-5-fluoro-2-methylaniline
CID 43307958
4-chloro-2-methyl-N-[1-(1-propylpiperidin-4-yl)ethyl]aniline
CID 43308115
N-[1-(1-ethylpiperidin-4-yl)ethyl]-4-fluoro-2-iodoaniline
CID 79768481
4-methoxy-2-methyl-N-[1-(1-propylpiperidin-4-yl)ethyl]aniline
CID 62865937
N-(2,4-dimethylphenyl)-1-ethylazepan-4-amine
CID 65072468
2-bromo-5-methyl-N-[1-(1-propylpiperidin-4-yl)ethyl]aniline
CID 82761319
N-[1-(1-ethylpiperidin-3-yl)ethyl]-4-iodo-2-methylaniline
CID 43716961
2-bromo-N-[1-(1-ethylpiperidin-3-yl)ethyl]-4-methylaniline
CID 43307483
2,4-dimethyl-N-[1-(oxolan-3-yl)ethyl]aniline
CID 115925815

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline?
The IUPAC name of N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline (CID 43307344) is N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline.
What is the SMILES notation for N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline?
The canonical SMILES for N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline is CCN1CCC(C(C)Nc2ccc(C)cc2C)CC1.
What is the InChIKey of N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline?
The InChIKey is CRJLDEFLDXSWNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-5-19-10-8-16(9-11-19)15(4)18-17-7-6-13(2)12-14(17)3/h6-7,12,15-16,18H,5,8-11H2,1-4H3.
What are the key properties of N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline?
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline has a molecular weight of 260.43 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline is sourced from PubChem (CID 43307344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).