2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline

C14H24N2O — CID 55010184

IUPAC2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline
SMILESCCN(c1ccccc1C(C)N)C(C)COC
InChIInChI=1S/C14H24N2O/c1-5-16(11(2)10-17-4)14-9-7-6-8-13(14)12(3)15/h6-9,11-12H,5,10,15H2,1-4H3
InChIKeyKJHJSRKHYVPRGF-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.57
Rot. Bonds6

About 2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline

2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline (PubChem CID 55010184) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline.

Molecular Properties

Compound Name2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline
PubChem CID55010184
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline
SMILESCCN(c1ccccc1C(C)N)C(C)COC
InChIInChI=1S/C14H24N2O/c1-5-16(11(2)10-17-4)14-9-7-6-8-13(14)12(3)15/h6-9,11-12H,5,10,15H2,1-4H3
InChIKeyKJHJSRKHYVPRGF-UHFFFAOYSA-N
XLogP2.57
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-[2-[ethyl(1-methoxypropan-2-yl)amino]phenyl]propan-1-ol
CID 103959999
2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline
CID 43269689
2-(1-aminopropyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)aniline
CID 115995066
2-[2-[(1R)-1-aminoethyl]-N-propan-2-ylanilino]ethanol
CID 78935304
2-[(1R)-1-aminopropyl]-N-(2-methoxyethyl)-N-propan-2-ylaniline
CID 103959097
2-[(1S)-1-aminoethyl]-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)aniline
CID 63368929
2-[(1R)-1-aminoethyl]-N-(3-methoxypropyl)-N-methylaniline
CID 78935486
3-[2-[(1S)-1-aminoethyl]-N-propan-2-ylanilino]propan-1-ol
CID 78935229
2-[(1R)-1-aminoethyl]-N-(2-ethoxyethyl)-N-ethylaniline
CID 63697735
2-(1-aminoethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)aniline
CID 54989680
2-(1-aminoethyl)-N-(2-methoxyethyl)-N-(2-methylpropyl)aniline
CID 54987089
2-[(1R)-1-aminoethyl]-N-ethyl-N-(2-methylpropyl)aniline
CID 78935741

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline?
The IUPAC name of 2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline (CID 55010184) is 2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline.
What is the SMILES notation for 2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline?
The canonical SMILES for 2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline is CCN(c1ccccc1C(C)N)C(C)COC.
What is the InChIKey of 2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline?
The InChIKey is KJHJSRKHYVPRGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-5-16(11(2)10-17-4)14-9-7-6-8-13(14)12(3)15/h6-9,11-12H,5,10,15H2,1-4H3.
What are the key properties of 2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline?
2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline has a molecular weight of 236.36 g/mol, XLogP of 2.57, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline is sourced from PubChem (CID 55010184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).