N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine

C7H13N3O — CID 146793469

IUPACN-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine
SMILESCCN(C)Cc1nnc(C)o1
InChIInChI=1S/C7H13N3O/c1-4-10(3)5-7-9-8-6(2)11-7/h4-5H2,1-3H3
InChIKeyRWHCJLSTTAZFMQ-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.83
Rot. Bonds3

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

N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine (PubChem CID 146793469) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine
PubChem CID146793469
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC NameN-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine
SMILESCCN(C)Cc1nnc(C)o1
InChIInChI=1S/C7H13N3O/c1-4-10(3)5-7-9-8-6(2)11-7/h4-5H2,1-3H3
InChIKeyRWHCJLSTTAZFMQ-UHFFFAOYSA-N
XLogP0.83
TPSA42.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine?
The IUPAC name of N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine (CID 146793469) is N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine.
What is the SMILES notation for N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine?
The canonical SMILES for N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine is CCN(C)Cc1nnc(C)o1.
What is the InChIKey of N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine?
The InChIKey is RWHCJLSTTAZFMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c1-4-10(3)5-7-9-8-6(2)11-7/h4-5H2,1-3H3.
What are the key properties of N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine?
N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine has a molecular weight of 155.20 g/mol, XLogP of 0.83, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine is sourced from PubChem (CID 146793469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).