1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine

C8H15N3O2 — CID 103605038

IUPAC1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine
SMILESCOCC(C)NCc1nnc(C)o1
InChIInChI=1S/C8H15N3O2/c1-6(5-12-3)9-4-8-11-10-7(2)13-8/h6,9H,4-5H2,1-3H3
InChIKeyRHEVPUNNTBGCID-UHFFFAOYSA-N
MW185.23 g/mol
LogP0.50
Rot. Bonds5

About 1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine

1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine (PubChem CID 103605038) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is 1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine.

Molecular Properties

Compound Name1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine
PubChem CID103605038
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC Name1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine
SMILESCOCC(C)NCc1nnc(C)o1
InChIInChI=1S/C8H15N3O2/c1-6(5-12-3)9-4-8-11-10-7(2)13-8/h6,9H,4-5H2,1-3H3
InChIKeyRHEVPUNNTBGCID-UHFFFAOYSA-N
XLogP0.50
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine?
The IUPAC name of 1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine (CID 103605038) is 1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine.
What is the SMILES notation for 1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine?
The canonical SMILES for 1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine is COCC(C)NCc1nnc(C)o1.
What is the InChIKey of 1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine?
The InChIKey is RHEVPUNNTBGCID-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c1-6(5-12-3)9-4-8-11-10-7(2)13-8/h6,9H,4-5H2,1-3H3.
What are the key properties of 1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine?
1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine has a molecular weight of 185.23 g/mol, XLogP of 0.50, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine is sourced from PubChem (CID 103605038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).