2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol

C11H20N2O2 — CID 60968327

IUPAC2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol
SMILESCCCCN(CCO)Cc1cc(C)no1
InChIInChI=1S/C11H20N2O2/c1-3-4-5-13(6-7-14)9-11-8-10(2)12-15-11/h8,14H,3-7,9H2,1-2H3
InChIKeyLRZHRVJOWMIVFW-UHFFFAOYSA-N
MW212.29 g/mol
LogP1.58
Rot. Bonds7

About 2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol

2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol (PubChem CID 60968327) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol
PubChem CID60968327
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol
SMILESCCCCN(CCO)Cc1cc(C)no1
InChIInChI=1S/C11H20N2O2/c1-3-4-5-13(6-7-14)9-11-8-10(2)12-15-11/h8,14H,3-7,9H2,1-2H3
InChIKeyLRZHRVJOWMIVFW-UHFFFAOYSA-N
XLogP1.58
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(dibutylamino)methyl]-1,2-oxazole-3-carboxylic acid
CID 61397880
2-[butyl-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]amino]ethanol
CID 60968468
5-[(dibutylamino)methyl]-1,2-oxazole-3-carbohydrazide
CID 63572496
5-[[ethyl(2-hydroxyethyl)amino]methyl]-1,2-oxazole-3-carboxylic acid
CID 61397882
5-heptyl-3-methyl-1,2-oxazole
CID 57223532
N-[[5-[(dibutylamino)methyl]-1,2-oxazol-3-yl]methyl]cyclopropanamine
CID 62418473
2-[butyl(2-hydroxyethyl)amino]ethanol
CID 23103220
7-(3-methyl-1,2-oxazol-5-yl)heptan-1-ol
CID 19894069
2-[2-hydroxyethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol
CID 62021320
2-[butyl-[(3,4-dichlorophenyl)methyl]amino]ethanol
CID 60689446
2-[butyl(2-hydroxyethyl)amino]ethanol;titanium
CID 174575595
2-[butyl-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]amino]ethanol
CID 61360390

Frequently Asked Questions

What is the IUPAC name of 2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol?
The IUPAC name of 2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol (CID 60968327) is 2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol.
What is the SMILES notation for 2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol?
The canonical SMILES for 2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol is CCCCN(CCO)Cc1cc(C)no1.
What is the InChIKey of 2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol?
The InChIKey is LRZHRVJOWMIVFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-3-4-5-13(6-7-14)9-11-8-10(2)12-15-11/h8,14H,3-7,9H2,1-2H3.
What are the key properties of 2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol?
2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol has a molecular weight of 212.29 g/mol, XLogP of 1.58, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]ethanol is sourced from PubChem (CID 60968327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).