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

C16H26N2O — CID 43307486

IUPACN-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline
SMILESCCN1CCC(C(C)Nc2ccccc2OC)CC1
InChIInChI=1S/C16H26N2O/c1-4-18-11-9-14(10-12-18)13(2)17-15-7-5-6-8-16(15)19-3/h5-8,13-14,17H,4,9-12H2,1-3H3
InChIKeyMGFQYHGHUIPNKQ-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.23
Rot. Bonds5

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

N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline (PubChem CID 43307486) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline.

Molecular Properties

Compound NameN-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline
PubChem CID43307486
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline
SMILESCCN1CCC(C(C)Nc2ccccc2OC)CC1
InChIInChI=1S/C16H26N2O/c1-4-18-11-9-14(10-12-18)13(2)17-15-7-5-6-8-16(15)19-3/h5-8,13-14,17H,4,9-12H2,1-3H3
InChIKeyMGFQYHGHUIPNKQ-UHFFFAOYSA-N
XLogP3.23
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-[1-(1-propylpiperidin-4-yl)ethyl]aniline
CID 43307485
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-propan-2-yloxyaniline
CID 43739139
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxy-5-methylaniline
CID 43307758
1-N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-N,2-N-dimethylbenzene-1,2-diamine
CID 43726410
2-(methoxymethyl)-N-[1-(1-propylpiperidin-4-yl)ethyl]aniline
CID 43677816
N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-fluoro-4-methoxyaniline
CID 43380417
4-chloro-N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-methoxyaniline
CID 107620997
4-bromo-N-[1-(1-ethylpiperidin-4-yl)ethyl]-3-methoxyaniline
CID 82857817
N-[1-(1-methylpiperidin-4-yl)ethyl]-2-propoxyaniline
CID 43682215
N-[1-(1-ethylpiperidin-4-yl)ethyl]-5-fluoro-2-methylaniline
CID 43307958
N-[1-(1-ethylpiperidin-4-yl)ethyl]-4-fluoro-2-iodoaniline
CID 79768481
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,4-dimethylaniline
CID 43307344

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline?
The IUPAC name of N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline (CID 43307486) is N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline.
What is the SMILES notation for N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline?
The canonical SMILES for N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline is CCN1CCC(C(C)Nc2ccccc2OC)CC1.
What is the InChIKey of N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline?
The InChIKey is MGFQYHGHUIPNKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-4-18-11-9-14(10-12-18)13(2)17-15-7-5-6-8-16(15)19-3/h5-8,13-14,17H,4,9-12H2,1-3H3.
What are the key properties of N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline?
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline has a molecular weight of 262.40 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methoxyaniline is sourced from PubChem (CID 43307486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).