N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline

C18H23NO — CID 43093553

IUPACN-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline
SMILESCCOc1ccc(C(C)Nc2ccc(CC)cc2)cc1
InChIInChI=1S/C18H23NO/c1-4-15-6-10-17(11-7-15)19-14(3)16-8-12-18(13-9-16)20-5-2/h6-14,19H,4-5H2,1-3H3
InChIKeyWULQJOOTBKSQDY-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.82
Rot. Bonds6

About N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline

N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline (PubChem CID 43093553) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline.

Molecular Properties

Compound NameN-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline
PubChem CID43093553
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC NameN-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline
SMILESCCOc1ccc(C(C)Nc2ccc(CC)cc2)cc1
InChIInChI=1S/C18H23NO/c1-4-15-6-10-17(11-7-15)19-14(3)16-8-12-18(13-9-16)20-5-2/h6-14,19H,4-5H2,1-3H3
InChIKeyWULQJOOTBKSQDY-UHFFFAOYSA-N
XLogP4.82
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[1-(4-ethoxyphenyl)ethylamino]phenyl]ethanol
CID 61236951
N-[1-(4-ethylphenyl)ethyl]aniline
CID 43190038
4-butyl-N-[1-(4-ethylphenyl)ethyl]aniline
CID 43100000
4-chloro-N-[1-(4-ethoxyphenyl)ethyl]-3-fluoroaniline
CID 43721449
4-ethyl-N-(1-pyridin-4-ylethyl)aniline
CID 43195541
N-[1-(4-ethylphenyl)ethyl]-3,5-dimethoxyaniline
CID 43106299
N-[1-(4-ethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine
CID 43104651
N-[1-(3-bromo-4-fluorophenyl)ethyl]-4-ethoxyaniline
CID 43757906
4-ethoxy-N-[2-(4-ethylphenoxy)propyl]aniline
CID 54796515
[2-[[(1R)-1-(4-ethylphenyl)ethyl]amino]-2-oxoethyl] 4-ethoxybenzoate
CID 8580616
1-[(4-ethoxyphenoxy)methyl]-3-[1-(4-ethylphenyl)ethyl]urea
CID 108890686
N-[1-(4-ethoxyphenyl)ethyl]-1,3-benzothiazol-6-amine
CID 107803950

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline?
The IUPAC name of N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline (CID 43093553) is N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline.
What is the SMILES notation for N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline?
The canonical SMILES for N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline is CCOc1ccc(C(C)Nc2ccc(CC)cc2)cc1.
What is the InChIKey of N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline?
The InChIKey is WULQJOOTBKSQDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-4-15-6-10-17(11-7-15)19-14(3)16-8-12-18(13-9-16)20-5-2/h6-14,19H,4-5H2,1-3H3.
What are the key properties of N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline?
N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline has a molecular weight of 269.39 g/mol, XLogP of 4.82, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline is sourced from PubChem (CID 43093553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).