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

C11H21N3O2 — CID 59777393

IUPACN-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine
SMILESCOCCN(Cc1nc(C)no1)C(C)(C)C
InChIInChI=1S/C11H21N3O2/c1-9-12-10(16-13-9)8-14(6-7-15-5)11(2,3)4/h6-8H2,1-5H3
InChIKeyOPEHXXKXQRXSMQ-UHFFFAOYSA-N
MW227.31 g/mol
LogP1.62
Rot. Bonds5

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

N-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine (PubChem CID 59777393) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine
PubChem CID59777393
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC NameN-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine
SMILESCOCCN(Cc1nc(C)no1)C(C)(C)C
InChIInChI=1S/C11H21N3O2/c1-9-12-10(16-13-9)8-14(6-7-15-5)11(2,3)4/h6-8H2,1-5H3
InChIKeyOPEHXXKXQRXSMQ-UHFFFAOYSA-N
XLogP1.62
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine?
The IUPAC name of N-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine (CID 59777393) is N-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine is COCCN(Cc1nc(C)no1)C(C)(C)C.
What is the InChIKey of N-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine?
The InChIKey is OPEHXXKXQRXSMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-9-12-10(16-13-9)8-14(6-7-15-5)11(2,3)4/h6-8H2,1-5H3.
What are the key properties of N-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine?
N-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine has a molecular weight of 227.31 g/mol, XLogP of 1.62, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine is sourced from PubChem (CID 59777393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).