2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol

C15H32N2O — CID 55056097

IUPAC2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol
SMILESCCCN(CCO)CC(CC)(CC)CNC1CC1
InChIInChI=1S/C15H32N2O/c1-4-9-17(10-11-18)13-15(5-2,6-3)12-16-14-7-8-14/h14,16,18H,4-13H2,1-3H3
InChIKeyFHBLAFCMGLSRDJ-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.25
Rot. Bonds11

About 2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol

2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol (PubChem CID 55056097) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol.

Molecular Properties

Compound Name2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol
PubChem CID55056097
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol
SMILESCCCN(CCO)CC(CC)(CC)CNC1CC1
InChIInChI=1S/C15H32N2O/c1-4-9-17(10-11-18)13-15(5-2,6-3)12-16-14-7-8-14/h14,16,18H,4-13H2,1-3H3
InChIKeyFHBLAFCMGLSRDJ-UHFFFAOYSA-N
XLogP2.25
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-(2,2,2-trifluoroethyl)amino]ethanol
CID 107486939
N,N'-dicyclopropyl-2,2-diethyl-N'-propylpropane-1,3-diamine
CID 62263843
N'-cyclopropyl-2,2-diethyl-N,N-bis(2-methylpropyl)propane-1,3-diamine
CID 63495326
2-[[2-ethyl-2-(propylaminomethyl)butyl]-(2-hydroxyethyl)amino]ethanol
CID 55056370
N-cyclopropyl-N'-(2-ethoxyethyl)-N',2,2-triethylpropane-1,3-diamine
CID 55225955
2-[[bis(2-hydroxyethyl)amino]methyl]-2-ethylbutan-1-ol
CID 62270229
N-cyclopropyl-2,2-diethyl-N'-methyl-N'-(4-methylcyclohexyl)propane-1,3-diamine
CID 63494489
N-cyclopropyl-2,2-diethyl-N'-methyl-N'-pentan-2-ylpropane-1,3-diamine
CID 62256141
2-[[2-ethyl-2-[(2-methylpropylamino)methyl]butyl]-(2-hydroxyethyl)amino]ethanol
CID 55056371
N,2,2-triethyl-N'-methyl-N-propylpropane-1,3-diamine
CID 62262351
3-[[2-[(cyclopropylamino)methyl]-2-methylbutyl]-ethylamino]propan-1-ol
CID 113469034
N-cyclohexyl-N'-cyclopropyl-2,2-diethyl-N-methylpropane-1,3-diamine
CID 62263046

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol?
The IUPAC name of 2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol (CID 55056097) is 2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol.
What is the SMILES notation for 2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol?
The canonical SMILES for 2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol is CCCN(CCO)CC(CC)(CC)CNC1CC1.
What is the InChIKey of 2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol?
The InChIKey is FHBLAFCMGLSRDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-4-9-17(10-11-18)13-15(5-2,6-3)12-16-14-7-8-14/h14,16,18H,4-13H2,1-3H3.
What are the key properties of 2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol?
2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol has a molecular weight of 256.43 g/mol, XLogP of 2.25, 11 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[(cyclopropylamino)methyl]-2-ethylbutyl]-propylamino]ethanol is sourced from PubChem (CID 55056097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).