N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine

C11H19N3O2 — CID 103539392

IUPACN-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine
SMILESCCNCc1coc(N2CCC(OC)C2)n1
InChIInChI=1S/C11H19N3O2/c1-3-12-6-9-8-16-11(13-9)14-5-4-10(7-14)15-2/h8,10,12H,3-7H2,1-2H3
InChIKeyFBWOUOYMWBNPMZ-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.01
Rot. Bonds5

About N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine

N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine (PubChem CID 103539392) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine
PubChem CID103539392
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC NameN-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine
SMILESCCNCc1coc(N2CCC(OC)C2)n1
InChIInChI=1S/C11H19N3O2/c1-3-12-6-9-8-16-11(13-9)14-5-4-10(7-14)15-2/h8,10,12H,3-7H2,1-2H3
InChIKeyFBWOUOYMWBNPMZ-UHFFFAOYSA-N
XLogP1.01
TPSA50.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[6-(3-methoxypyrrolidin-1-yl)pyrazin-2-yl]methyl]ethanamine
CID 103539323
2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole
CID 130719650
N-[[2-(3-methoxy-4-methylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-1-amine
CID 102967632
N-[[2-[3-(methoxymethyl)piperidin-1-yl]-1,3-oxazol-4-yl]methyl]propan-1-amine
CID 106589222
N-[[3-chloro-6-(3-methoxypyrrolidin-1-yl)-2-pyridinyl]methyl]ethanamine
CID 103539397
N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methanamine
CID 103503007
N-[[2-(3,3-dimethylmorpholin-4-yl)-1,3-oxazol-4-yl]methyl]ethanamine
CID 113377733
N-[[5-(3-methoxypyrrolidin-1-yl)-2-propan-2-ylpyrimidin-4-yl]methyl]ethanamine
CID 103539456
N-[[5-(3-methoxypyrrolidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl]propan-1-amine
CID 106967372
N-[[1-(3-methoxypyrrolidin-1-yl)isoquinolin-4-yl]methyl]ethanamine
CID 106777093
2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 103503049
N-[[2-(3,4-dimethylcyclohexyl)oxy-1,3-oxazol-4-yl]methyl]ethanamine
CID 113378067

Frequently Asked Questions

What is the IUPAC name of N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine?
The IUPAC name of N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine (CID 103539392) is N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine?
The canonical SMILES for N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine is CCNCc1coc(N2CCC(OC)C2)n1.
What is the InChIKey of N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine?
The InChIKey is FBWOUOYMWBNPMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-3-12-6-9-8-16-11(13-9)14-5-4-10(7-14)15-2/h8,10,12H,3-7H2,1-2H3.
What are the key properties of N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine?
N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine has a molecular weight of 225.29 g/mol, XLogP of 1.01, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine is sourced from PubChem (CID 103539392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).