2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline

C15H18N2O — CID 43750320

IUPAC2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline
SMILESCCOCc1ccccc1NCc1cccnc1
InChIInChI=1S/C15H18N2O/c1-2-18-12-14-7-3-4-8-15(14)17-11-13-6-5-9-16-10-13/h3-10,17H,2,11-12H2,1H3
InChIKeyKXZIPIBUJQGCBO-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.23
Rot. Bonds6

About 2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline

2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline (PubChem CID 43750320) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline.

Molecular Properties

Compound Name2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline
PubChem CID43750320
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline
SMILESCCOCc1ccccc1NCc1cccnc1
InChIInChI=1S/C15H18N2O/c1-2-18-12-14-7-3-4-8-15(14)17-11-13-6-5-9-16-10-13/h3-10,17H,2,11-12H2,1H3
InChIKeyKXZIPIBUJQGCBO-UHFFFAOYSA-N
XLogP3.23
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(ethoxymethyl)-N-(pyrimidin-5-ylmethyl)aniline
CID 62759362
2-(chloromethyl)-N-(pyridin-3-ylmethyl)aniline
CID 65024391
[2-(pyridin-3-ylmethylamino)phenyl]methanol
CID 43743160
N-[(1-tert-butylpyrazol-4-yl)methyl]-2-(ethoxymethyl)aniline
CID 43792111
2-(ethoxymethyl)-N-ethylaniline
CID 43750443
N-[(3-cyclopropylphenyl)methyl]-2-(ethoxymethyl)aniline
CID 79968881
2-N-(pyridin-3-ylmethyl)benzene-1,2-diamine
CID 22184587
4-[[2-(ethoxymethyl)anilino]methyl]-2,6-difluorophenol
CID 79832570
2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine
CID 75356077
2-ethyl-N-(2-pyridin-3-ylethyl)aniline
CID 55169393
2-(ethoxymethyl)-N-(thiophen-2-ylmethyl)aniline
CID 43750319
2-(2-methylpropoxy)-N-(pyridin-3-ylmethyl)aniline
CID 54864920

Frequently Asked Questions

What is the IUPAC name of 2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline?
The IUPAC name of 2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline (CID 43750320) is 2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline.
What is the SMILES notation for 2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline?
The canonical SMILES for 2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline is CCOCc1ccccc1NCc1cccnc1.
What is the InChIKey of 2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline?
The InChIKey is KXZIPIBUJQGCBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-2-18-12-14-7-3-4-8-15(14)17-11-13-6-5-9-16-10-13/h3-10,17H,2,11-12H2,1H3.
What are the key properties of 2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline?
2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline has a molecular weight of 242.32 g/mol, XLogP of 3.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethoxymethyl)-N-(pyridin-3-ylmethyl)aniline is sourced from PubChem (CID 43750320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).