2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol

C14H24N2O2 — CID 113371170

IUPAC2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol
SMILESCCCCN(CCO)c1ncccc1OCCC
InChIInChI=1S/C14H24N2O2/c1-3-5-9-16(10-11-17)14-13(18-12-4-2)7-6-8-15-14/h6-8,17H,3-5,9-12H2,1-2H3
InChIKeyKJSKTYDVKJUSCO-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.47
Rot. Bonds9

About 2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol

2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol (PubChem CID 113371170) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol.

Molecular Properties

Compound Name2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol
PubChem CID113371170
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol
SMILESCCCCN(CCO)c1ncccc1OCCC
InChIInChI=1S/C14H24N2O2/c1-3-5-9-16(10-11-17)14-13(18-12-4-2)7-6-8-15-14/h6-8,17H,3-5,9-12H2,1-2H3
InChIKeyKJSKTYDVKJUSCO-UHFFFAOYSA-N
XLogP2.47
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[methyl-(3-propoxy-2-pyridinyl)amino]pentan-1-ol
CID 107203500
2-[butyl(2-hydroxyethyl)amino]-N'-hydroxypyridine-3-carboximidamide
CID 61446274
N,N-dibutyl-3-chloropyridin-2-amine
CID 135025261
2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol
CID 62734185
(1S)-1-[2-(dibutylamino)-3-pyridinyl]ethanol
CID 114055796
2-[(5-bromoisoquinolin-1-yl)-butylamino]ethanol
CID 106541425
N,N-dibutyl-3-(methylaminomethyl)pyridin-2-amine
CID 62279311
2-[(5-methoxyisoquinolin-1-yl)-propylamino]ethanol
CID 106541421
2-[butyl-[4-(hydroxymethyl)isoquinolin-1-yl]amino]ethanol
CID 106768099
2-[butyl(quinazolin-4-yl)amino]ethanol
CID 61448133
2-(2-amino-N-butyl-4-fluoro-5-propoxyanilino)ethanol
CID 63592250
2-[(2-aminopyrimidin-4-yl)-butylamino]ethanol
CID 80808960

Frequently Asked Questions

What is the IUPAC name of 2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol?
The IUPAC name of 2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol (CID 113371170) is 2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol.
What is the SMILES notation for 2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol?
The canonical SMILES for 2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol is CCCCN(CCO)c1ncccc1OCCC.
What is the InChIKey of 2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol?
The InChIKey is KJSKTYDVKJUSCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-3-5-9-16(10-11-17)14-13(18-12-4-2)7-6-8-15-14/h6-8,17H,3-5,9-12H2,1-2H3.
What are the key properties of 2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol?
2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol has a molecular weight of 252.36 g/mol, XLogP of 2.47, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl-(3-propoxy-2-pyridinyl)amino]ethanol is sourced from PubChem (CID 113371170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).