2-[(6-amino-3-pyridinyl)-butylamino]ethanol

C11H19N3O — CID 61444320

IUPAC2-[(6-amino-3-pyridinyl)-butylamino]ethanol
SMILESCCCCN(CCO)c1ccc(N)nc1
InChIInChI=1S/C11H19N3O/c1-2-3-6-14(7-8-15)10-4-5-11(12)13-9-10/h4-5,9,15H,2-3,6-8H2,1H3,(H2,12,13)
InChIKeyLWZZUMIRXKDCNI-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.26
Rot. Bonds6

About 2-[(6-amino-3-pyridinyl)-butylamino]ethanol

2-[(6-amino-3-pyridinyl)-butylamino]ethanol (PubChem CID 61444320) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-[(6-amino-3-pyridinyl)-butylamino]ethanol.

Molecular Properties

Compound Name2-[(6-amino-3-pyridinyl)-butylamino]ethanol
PubChem CID61444320
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-[(6-amino-3-pyridinyl)-butylamino]ethanol
SMILESCCCCN(CCO)c1ccc(N)nc1
InChIInChI=1S/C11H19N3O/c1-2-3-6-14(7-8-15)10-4-5-11(12)13-9-10/h4-5,9,15H,2-3,6-8H2,1H3,(H2,12,13)
InChIKeyLWZZUMIRXKDCNI-UHFFFAOYSA-N
XLogP1.26
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-N-[2-(methylamino)ethyl]-5-N-propylpyridine-2,5-diamine
CID 148883804
5-N-(2-methoxyethyl)-5-N-propylpyridine-2,5-diamine
CID 156651791
6-amino-N-butyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 62160208
6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine
CID 103936956
4-[butyl(2-hydroxyethyl)amino]benzenesulfonamide
CID 61448189
butan-1-ol;5-chloropyridin-2-amine
CID 174845448
(1R)-1-[4-[butyl(2-hydroxyethyl)amino]phenyl]ethanol
CID 55184841
N'-hydroxy-5-[2-hydroxyethyl(propyl)amino]pyridine-2-carboximidamide
CID 136990539
2-[[6-(aminomethyl)-3-pyridinyl]-butylamino]acetamide
CID 115486965
2-[(2-aminopyrimidin-4-yl)-butylamino]ethanol
CID 80808960
1-[5-[2-hydroxyethyl(propyl)amino]-2-pyridinyl]propan-1-ol
CID 112585320
2-[N-butyl-4-[1-(methylamino)ethyl]anilino]ethanol
CID 61446426

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-3-pyridinyl)-butylamino]ethanol?
The IUPAC name of 2-[(6-amino-3-pyridinyl)-butylamino]ethanol (CID 61444320) is 2-[(6-amino-3-pyridinyl)-butylamino]ethanol.
What is the SMILES notation for 2-[(6-amino-3-pyridinyl)-butylamino]ethanol?
The canonical SMILES for 2-[(6-amino-3-pyridinyl)-butylamino]ethanol is CCCCN(CCO)c1ccc(N)nc1.
What is the InChIKey of 2-[(6-amino-3-pyridinyl)-butylamino]ethanol?
The InChIKey is LWZZUMIRXKDCNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-2-3-6-14(7-8-15)10-4-5-11(12)13-9-10/h4-5,9,15H,2-3,6-8H2,1H3,(H2,12,13).
What are the key properties of 2-[(6-amino-3-pyridinyl)-butylamino]ethanol?
2-[(6-amino-3-pyridinyl)-butylamino]ethanol has a molecular weight of 209.29 g/mol, XLogP of 1.26, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-3-pyridinyl)-butylamino]ethanol is sourced from PubChem (CID 61444320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).