2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol

C15H20N2O2 — CID 60693417

IUPAC2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol
SMILESCCCN(CCO)Cc1cc(-c2ccccc2)on1
InChIInChI=1S/C15H20N2O2/c1-2-8-17(9-10-18)12-14-11-15(19-16-14)13-6-4-3-5-7-13/h3-7,11,18H,2,8-10,12H2,1H3
InChIKeyDGUNAUOKZQWPQO-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.55
Rot. Bonds7

About 2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol

2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol (PubChem CID 60693417) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol.

Molecular Properties

Compound Name2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol
PubChem CID60693417
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol
SMILESCCCN(CCO)Cc1cc(-c2ccccc2)on1
InChIInChI=1S/C15H20N2O2/c1-2-8-17(9-10-18)12-14-11-15(19-16-14)13-6-4-3-5-7-13/h3-7,11,18H,2,8-10,12H2,1H3
InChIKeyDGUNAUOKZQWPQO-UHFFFAOYSA-N
XLogP2.55
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]ethanol
CID 60683924
N-[(5-phenyl-1,2-oxazol-3-yl)methyl]-N-propylacetamide
CID 42656369
3-[ethyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]propanoic acid
CID 61009666
3-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]propanoic acid
CID 60988202
N'-ethyl-2,2-dimethyl-N'-[(5-phenyl-1,2-oxazol-3-yl)methyl]propane-1,3-diamine
CID 79664342
ethyl 2-[benzyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]acetate
CID 113330854
2-[ethyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]-2-methylpropanoic acid
CID 62820490
2-[cyclopropylmethyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]acetic acid
CID 43656694
3-[ethyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]butanoic acid
CID 62825872
2-[2-hydroxyethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol
CID 62021320
2-[(4-methyl-2-phenyl-1,3-thiazol-5-yl)methyl-propylamino]ethanol
CID 110921349
2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propan-2-ylamino]acetic acid
CID 60840315

Frequently Asked Questions

What is the IUPAC name of 2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol?
The IUPAC name of 2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol (CID 60693417) is 2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol.
What is the SMILES notation for 2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol?
The canonical SMILES for 2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol is CCCN(CCO)Cc1cc(-c2ccccc2)on1.
What is the InChIKey of 2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol?
The InChIKey is DGUNAUOKZQWPQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-2-8-17(9-10-18)12-14-11-15(19-16-14)13-6-4-3-5-7-13/h3-7,11,18H,2,8-10,12H2,1H3.
What are the key properties of 2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol?
2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol has a molecular weight of 260.34 g/mol, XLogP of 2.55, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-phenyl-1,2-oxazol-3-yl)methyl-propylamino]ethanol is sourced from PubChem (CID 60693417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).