1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol

C11H19N3O2 — CID 111858607

IUPAC1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol
SMILESCCc1noc(CN(C)CC(O)C2CC2)n1
InChIInChI=1S/C11H19N3O2/c1-3-10-12-11(16-13-10)7-14(2)6-9(15)8-4-5-8/h8-9,15H,3-7H2,1-2H3
InChIKeyNSOAFXSMHPSEQT-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.83
Rot. Bonds6

About 1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol

1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol (PubChem CID 111858607) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol
PubChem CID111858607
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol
SMILESCCc1noc(CN(C)CC(O)C2CC2)n1
InChIInChI=1S/C11H19N3O2/c1-3-10-12-11(16-13-10)7-14(2)6-9(15)8-4-5-8/h8-9,15H,3-7H2,1-2H3
InChIKeyNSOAFXSMHPSEQT-UHFFFAOYSA-N
XLogP0.83
TPSA62.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]amino]propan-2-ol
CID 62332798
methyl 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]-2-methylpropanoate
CID 60971190
1-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]-4-methylcyclohexan-1-ol
CID 111461808
2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]acetic acid
CID 43442230
1-cyclopropyl-2-[3-[2-(dimethylamino)ethyl]-1,2,4-oxadiazol-5-yl]ethanol
CID 115347281
1-cyclopentyl-2-[3-[(dimethylamino)methyl]-1,2,4-oxadiazol-5-yl]ethanol
CID 113390662
1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]-3-(4-fluorophenoxy)propan-2-ol
CID 110929749
(2R)-3-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propane-1,2-diol
CID 124755326
[3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol
CID 111976726
1-cyclopropyl-2-[3-(2-ethoxyethyl)-1,2,4-oxadiazol-5-yl]ethanol
CID 106815685
2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]propanoic acid
CID 62637255
1-cyclopropyl-2-[methyl-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]amino]ethanol
CID 111858859

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol?
The IUPAC name of 1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol (CID 111858607) is 1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol.
What is the SMILES notation for 1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol?
The canonical SMILES for 1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol is CCc1noc(CN(C)CC(O)C2CC2)n1.
What is the InChIKey of 1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol?
The InChIKey is NSOAFXSMHPSEQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-3-10-12-11(16-13-10)7-14(2)6-9(15)8-4-5-8/h8-9,15H,3-7H2,1-2H3.
What are the key properties of 1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol?
1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol has a molecular weight of 225.29 g/mol, XLogP of 0.83, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol is sourced from PubChem (CID 111858607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).