2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline

C14H24N2 — CID 43269689

IUPAC2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline
SMILESCCCN(c1ccccc1C(C)N)C(C)C
InChIInChI=1S/C14H24N2/c1-5-10-16(11(2)3)14-9-7-6-8-13(14)12(4)15/h6-9,11-12H,5,10,15H2,1-4H3
InChIKeyYQINSQKHEKLTSV-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.33
Rot. Bonds5

About 2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline

2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline (PubChem CID 43269689) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline.

Molecular Properties

Compound Name2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline
PubChem CID43269689
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline
SMILESCCCN(c1ccccc1C(C)N)C(C)C
InChIInChI=1S/C14H24N2/c1-5-10-16(11(2)3)14-9-7-6-8-13(14)12(4)15/h6-9,11-12H,5,10,15H2,1-4H3
InChIKeyYQINSQKHEKLTSV-UHFFFAOYSA-N
XLogP3.33
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-[(1R)-1-aminoethyl]-N-propan-2-ylanilino]ethanol
CID 78935304
3-[2-[(1S)-1-aminoethyl]-N-propan-2-ylanilino]propan-1-ol
CID 78935229
2-[(1R)-1-aminoethyl]-N-methyl-N-propylaniline
CID 78936089
(1S)-1-[2-[propan-2-yl(propyl)amino]phenyl]propan-1-ol
CID 103959740
2-[(1S)-1-aminopropyl]-N-pentyl-N-propan-2-ylaniline
CID 103958727
N'-[2-[(1S)-1-aminoethyl]phenyl]-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 78935470
2-(1-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)aniline
CID 55010184
2-[(1R)-1-aminopropyl]-N-(2-methoxyethyl)-N-propan-2-ylaniline
CID 103959097
(1R)-1-[2-[ethyl(propan-2-yl)amino]phenyl]ethanol
CID 78939531
2-[2-[(1R)-1-aminoethyl]-N-ethylanilino]ethanol
CID 78934890
(1R)-1-[2-[3-hydroxypropyl(propan-2-yl)amino]phenyl]propan-1-ol
CID 113358988
2-[1-(ethylamino)ethyl]-N-pentyl-N-propan-2-ylaniline
CID 63533282

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline?
The IUPAC name of 2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline (CID 43269689) is 2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline.
What is the SMILES notation for 2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline?
The canonical SMILES for 2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline is CCCN(c1ccccc1C(C)N)C(C)C.
What is the InChIKey of 2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline?
The InChIKey is YQINSQKHEKLTSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-5-10-16(11(2)3)14-9-7-6-8-13(14)12(4)15/h6-9,11-12H,5,10,15H2,1-4H3.
What are the key properties of 2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline?
2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline has a molecular weight of 220.36 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminoethyl)-N-propan-2-yl-N-propylaniline is sourced from PubChem (CID 43269689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).