1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine

C11H19N3O — CID 115085267

IUPAC1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine
SMILESCC(N)c1cnc(CC2CCN(C)C2)o1
InChIInChI=1S/C11H19N3O/c1-8(12)10-6-13-11(15-10)5-9-3-4-14(2)7-9/h6,8-9H,3-5,7,12H2,1-2H3
InChIKeyFQXVOWQRKGMRFK-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.19
Rot. Bonds3

About 1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine

1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine (PubChem CID 115085267) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine.

Molecular Properties

Compound Name1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine
PubChem CID115085267
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine
SMILESCC(N)c1cnc(CC2CCN(C)C2)o1
InChIInChI=1S/C11H19N3O/c1-8(12)10-6-13-11(15-10)5-9-3-4-14(2)7-9/h6,8-9H,3-5,7,12H2,1-2H3
InChIKeyFQXVOWQRKGMRFK-UHFFFAOYSA-N
XLogP1.19
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-[(1-methylpiperidin-4-yl)methyl]-1,3-oxazol-5-yl]ethanamine
CID 115085427
2-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanol
CID 115085223
[2-[(1-methylpiperidin-4-yl)methyl]-1,3-oxazol-5-yl]methanol
CID 115085355
1-[2-(thian-4-ylmethyl)-1,3-oxazol-5-yl]ethanol
CID 115085353
1-(1-methylpyrrolidin-3-yl)propan-2-amine
CID 71433430
2-[2-(piperidin-4-ylmethyl)-1,3-oxazol-5-yl]propan-1-amine
CID 115085410
1-[2-[(1,1-dioxothiolan-3-yl)methyl]-1,3-oxazol-5-yl]ethanol
CID 115085191
1-[2-[(1-methylpiperidin-2-yl)methyl]-1,3-oxazol-5-yl]ethanol
CID 115086123
1-[4-[(1-methylpyrrolidin-3-yl)methoxy]phenyl]ethanamine
CID 117052228
1-[2-[(1-methylpiperidin-3-yl)methyl]-1,3-thiazol-5-yl]propan-2-ol
CID 115091086
N-methyl-1-[2-(oxolan-3-ylmethyl)-1,3-oxazol-5-yl]ethanamine
CID 115085273
1-[2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazol-5-yl]ethanamine
CID 115084987

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine?
The IUPAC name of 1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine (CID 115085267) is 1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine.
What is the SMILES notation for 1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine?
The canonical SMILES for 1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine is CC(N)c1cnc(CC2CCN(C)C2)o1.
What is the InChIKey of 1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine?
The InChIKey is FQXVOWQRKGMRFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-8(12)10-6-13-11(15-10)5-9-3-4-14(2)7-9/h6,8-9H,3-5,7,12H2,1-2H3.
What are the key properties of 1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine?
1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine has a molecular weight of 209.29 g/mol, XLogP of 1.19, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(1-methylpyrrolidin-3-yl)methyl]-1,3-oxazol-5-yl]ethanamine is sourced from PubChem (CID 115085267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).