2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol

C15H27N3O — CID 112584333

IUPAC2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol
SMILESCCNC(CC)c1ccc(N(CCO)C(C)C)cn1
InChIInChI=1S/C15H27N3O/c1-5-14(16-6-2)15-8-7-13(11-17-15)18(9-10-19)12(3)4/h7-8,11-12,14,16,19H,5-6,9-10H2,1-4H3
InChIKeyMXLYBUVPPAFKIH-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.35
Rot. Bonds8

About 2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol

2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol (PubChem CID 112584333) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol.

Molecular Properties

Compound Name2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol
PubChem CID112584333
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol
SMILESCCNC(CC)c1ccc(N(CCO)C(C)C)cn1
InChIInChI=1S/C15H27N3O/c1-5-14(16-6-2)15-8-7-13(11-17-15)18(9-10-19)12(3)4/h7-8,11-12,14,16,19H,5-6,9-10H2,1-4H3
InChIKeyMXLYBUVPPAFKIH-UHFFFAOYSA-N
XLogP2.35
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]propan-1-ol
CID 115939424
2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-methylamino]propan-1-ol
CID 104552388
2-[2,2-difluoroethyl-[6-[1-(ethylamino)propyl]-3-pyridinyl]amino]ethanol
CID 107480571
6-[1-(ethylamino)propyl]-N,N-dimethylpyridin-3-amine
CID 112584103
6-[1-(ethylamino)propyl]-N-methyl-N-(3-methylbutyl)pyridin-3-amine
CID 112584276
(1S)-1-[5-[propan-2-yl(propyl)amino]-2-pyridinyl]propan-1-ol
CID 103938356
6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine
CID 115939736
2-[methyl-[6-[1-(methylamino)propyl]-3-pyridinyl]amino]ethanol
CID 112584231
N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine
CID 102994077
6-[1-(ethylamino)propyl]-N-prop-2-enyl-N-propylpyridin-3-amine
CID 112584559
N-cyclopropyl-6-[1-(ethylamino)propyl]-N-(3-methylbutyl)pyridin-3-amine
CID 115939457
1-[5-[pentyl(propan-2-yl)amino]-2-pyridinyl]propan-1-ol
CID 112585369

Frequently Asked Questions

What is the IUPAC name of 2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol?
The IUPAC name of 2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol (CID 112584333) is 2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol.
What is the SMILES notation for 2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol?
The canonical SMILES for 2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol is CCNC(CC)c1ccc(N(CCO)C(C)C)cn1.
What is the InChIKey of 2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol?
The InChIKey is MXLYBUVPPAFKIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-5-14(16-6-2)15-8-7-13(11-17-15)18(9-10-19)12(3)4/h7-8,11-12,14,16,19H,5-6,9-10H2,1-4H3.
What are the key properties of 2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol?
2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol has a molecular weight of 265.40 g/mol, XLogP of 2.35, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol is sourced from PubChem (CID 112584333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).