2-[3-(cyclopropylamino)propyl-ethylamino]ethanol

C10H22N2O — CID 61387148

IUPAC2-[3-(cyclopropylamino)propyl-ethylamino]ethanol
SMILESCCN(CCO)CCCNC1CC1
InChIInChI=1S/C10H22N2O/c1-2-12(8-9-13)7-3-6-11-10-4-5-10/h10-11,13H,2-9H2,1H3
InChIKeyUKAICARGKFWFEL-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.44
Rot. Bonds8

About 2-[3-(cyclopropylamino)propyl-ethylamino]ethanol

2-[3-(cyclopropylamino)propyl-ethylamino]ethanol (PubChem CID 61387148) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 2-[3-(cyclopropylamino)propyl-ethylamino]ethanol.

Molecular Properties

Compound Name2-[3-(cyclopropylamino)propyl-ethylamino]ethanol
PubChem CID61387148
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name2-[3-(cyclopropylamino)propyl-ethylamino]ethanol
SMILESCCN(CCO)CCCNC1CC1
InChIInChI=1S/C10H22N2O/c1-2-12(8-9-13)7-3-6-11-10-4-5-10/h10-11,13H,2-9H2,1H3
InChIKeyUKAICARGKFWFEL-UHFFFAOYSA-N
XLogP0.44
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-N',N'-diethylpropane-1,3-diamine
CID 60866749
N-cyclopropyl-N'-ethyl-N'-propylpropane-1,3-diamine
CID 60867670
N-cyclopropyl-N',N'-diethylpentane-1,5-diamine
CID 62438484
N',N'-diethyl-N-[4-(trifluoromethyl)cyclohexyl]propane-1,3-diamine
CID 64756068
1-[3-(cyclopropylamino)propyl-(2-hydroxypropyl)amino]propan-2-ol
CID 149151323
N',N'-diethyl-N-(4-propylcycloheptyl)propane-1,3-diamine
CID 65087423
N',N'-dibutyl-N-cyclopentylpropane-1,3-diamine
CID 55087820
4-[3-(diethylamino)propylamino]piperidine-1-carboxamide
CID 43763196
N'-butyl-N-cycloheptyl-N'-ethylethane-1,2-diamine
CID 62575467
2-[ethyl-[3-(propylamino)propyl]amino]ethanol
CID 61387164
3-[[2-[(cyclopropylamino)methyl]-2-methylbutyl]-ethylamino]propan-1-ol
CID 113469034
2-[3-(2-aminoethylamino)propyl-ethylamino]ethanol
CID 143093735

Frequently Asked Questions

What is the IUPAC name of 2-[3-(cyclopropylamino)propyl-ethylamino]ethanol?
The IUPAC name of 2-[3-(cyclopropylamino)propyl-ethylamino]ethanol (CID 61387148) is 2-[3-(cyclopropylamino)propyl-ethylamino]ethanol.
What is the SMILES notation for 2-[3-(cyclopropylamino)propyl-ethylamino]ethanol?
The canonical SMILES for 2-[3-(cyclopropylamino)propyl-ethylamino]ethanol is CCN(CCO)CCCNC1CC1.
What is the InChIKey of 2-[3-(cyclopropylamino)propyl-ethylamino]ethanol?
The InChIKey is UKAICARGKFWFEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-2-12(8-9-13)7-3-6-11-10-4-5-10/h10-11,13H,2-9H2,1H3.
What are the key properties of 2-[3-(cyclopropylamino)propyl-ethylamino]ethanol?
2-[3-(cyclopropylamino)propyl-ethylamino]ethanol has a molecular weight of 186.30 g/mol, XLogP of 0.44, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(cyclopropylamino)propyl-ethylamino]ethanol is sourced from PubChem (CID 61387148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).