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

C9H16N2O3 — CID 111487772

IUPAC2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol
SMILESCc1cnc(CN(CCO)CCO)o1
InChIInChI=1S/C9H16N2O3/c1-8-6-10-9(14-8)7-11(2-4-12)3-5-13/h6,12-13H,2-5,7H2,1H3
InChIKeyAFJMPFAXACBERE-UHFFFAOYSA-N
MW200.24 g/mol
LogP-0.23
Rot. Bonds6

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

2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol (PubChem CID 111487772) has the molecular formula C9H16N2O3 and a molecular weight of 200.24 g/mol. Its IUPAC name is 2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol
PubChem CID111487772
Molecular FormulaC9H16N2O3
Molecular Weight200.24 g/mol
Exact Mass200.12
IUPAC Name2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol
SMILESCc1cnc(CN(CCO)CCO)o1
InChIInChI=1S/C9H16N2O3/c1-8-6-10-9(14-8)7-11(2-4-12)3-5-13/h6,12-13H,2-5,7H2,1H3
InChIKeyAFJMPFAXACBERE-UHFFFAOYSA-N
XLogP-0.23
TPSA69.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-2-[2-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,3-oxazole
CID 148627248
2-[[5-(2-bromophenyl)-1,3-oxazol-2-yl]methyl-(2-hydroxyethyl)amino]ethanol
CID 111487783
3-[2-hydroxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]propan-1-ol
CID 111112523
methyl-[(5-methyl-1,3-oxazol-2-yl)methyl]cyanamide
CID 130627505
2-[butyl-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methyl]amino]ethanol
CID 60689589
2-[[5-(4-chlorophenyl)-1,3-oxazol-2-yl]methyl-ethylamino]ethanol
CID 60686061
2-[[5-(3-bromophenyl)-1,3-oxazol-2-yl]methyl-(2-hydroxyethyl)amino]ethanol
CID 111487788
2-[ethyl-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methyl]amino]ethanol
CID 60686062
3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-1-ol
CID 106371738
2-[[5-(3-bromophenyl)-1,3-oxazol-2-yl]methyl-propylamino]ethanol
CID 111487479
2-[[5-(3-chlorophenyl)-1,3-oxazol-2-yl]methyl-propylamino]ethanol
CID 60696759
2-[2-hydroxyethyl-[(5-methyl-3-pyridinyl)methyl]amino]ethanol
CID 102794628

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol?
The IUPAC name of 2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol (CID 111487772) is 2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol.
What is the SMILES notation for 2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol?
The canonical SMILES for 2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol is Cc1cnc(CN(CCO)CCO)o1.
What is the InChIKey of 2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol?
The InChIKey is AFJMPFAXACBERE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3/c1-8-6-10-9(14-8)7-11(2-4-12)3-5-13/h6,12-13H,2-5,7H2,1H3.
What are the key properties of 2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol?
2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol has a molecular weight of 200.24 g/mol, XLogP of -0.23, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl-[(5-methyl-1,3-oxazol-2-yl)methyl]amino]ethanol is sourced from PubChem (CID 111487772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).