N-ethyl-2,5-dipropoxyaniline

C14H23NO2 — CID 82267866

IUPACN-ethyl-2,5-dipropoxyaniline
SMILESCCCOc1ccc(OCCC)c(NCC)c1
InChIInChI=1S/C14H23NO2/c1-4-9-16-12-7-8-14(17-10-5-2)13(11-12)15-6-3/h7-8,11,15H,4-6,9-10H2,1-3H3
InChIKeyXBSZWBHXXMUDMO-UHFFFAOYSA-N
MW237.34 g/mol
LogP3.70
Rot. Bonds8

About N-ethyl-2,5-dipropoxyaniline

N-ethyl-2,5-dipropoxyaniline (PubChem CID 82267866) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is N-ethyl-2,5-dipropoxyaniline.

Molecular Properties

Compound NameN-ethyl-2,5-dipropoxyaniline
PubChem CID82267866
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC NameN-ethyl-2,5-dipropoxyaniline
SMILESCCCOc1ccc(OCCC)c(NCC)c1
InChIInChI=1S/C14H23NO2/c1-4-9-16-12-7-8-14(17-10-5-2)13(11-12)15-6-3/h7-8,11,15H,4-6,9-10H2,1-3H3
InChIKeyXBSZWBHXXMUDMO-UHFFFAOYSA-N
XLogP3.70
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2,3-dimethyl-4-propoxyaniline
CID 82266389
N-ethyl-2,5-bis(phenylmethoxy)aniline
CID 15565906
N-ethyl-2-methyl-6-propoxyquinolin-4-amine
CID 55060024
N-ethyl-2-propan-2-yl-6-propoxyquinolin-4-amine
CID 63483124
N-ethyl-8-propoxyquinolin-5-amine
CID 82264799
N-ethyl-2-(2-phenoxyethoxy)aniline
CID 54801094
1-[2-(2,5-dipropoxyphenyl)ethynyl]-4-[2-[4-[2-(2,5-dipropoxyphenyl)ethynyl]-2,5-dipropoxyphenyl]ethynyl]-2,5-dipropoxybenzene
CID 11828930
N-[(2,4-dipropoxyphenyl)methyl]-2-methylpropan-2-amine
CID 63062146
2-(5-methyl-2-propoxyanilino)ethanethiol
CID 83961741
5-tert-butyl-N-methyl-2-propoxyaniline
CID 82264393
2-(5-fluoro-2-propoxyanilino)ethanol
CID 167924183
N-(cyclopropylmethyl)-5-methyl-2-propoxyaniline
CID 83961753

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,5-dipropoxyaniline?
The IUPAC name of N-ethyl-2,5-dipropoxyaniline (CID 82267866) is N-ethyl-2,5-dipropoxyaniline.
What is the SMILES notation for N-ethyl-2,5-dipropoxyaniline?
The canonical SMILES for N-ethyl-2,5-dipropoxyaniline is CCCOc1ccc(OCCC)c(NCC)c1.
What is the InChIKey of N-ethyl-2,5-dipropoxyaniline?
The InChIKey is XBSZWBHXXMUDMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-4-9-16-12-7-8-14(17-10-5-2)13(11-12)15-6-3/h7-8,11,15H,4-6,9-10H2,1-3H3.
What are the key properties of N-ethyl-2,5-dipropoxyaniline?
N-ethyl-2,5-dipropoxyaniline has a molecular weight of 237.34 g/mol, XLogP of 3.70, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,5-dipropoxyaniline is sourced from PubChem (CID 82267866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).