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

C12H19N5O2 — CID 77078626

IUPAC1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine
SMILESCOCCn1ccnc1CN(C)Cc1nnc(C)o1
InChIInChI=1S/C12H19N5O2/c1-10-14-15-12(19-10)9-16(2)8-11-13-4-5-17(11)6-7-18-3/h4-5H,6-9H2,1-3H3
InChIKeyGKDQIUXGOQLCTR-UHFFFAOYSA-N
MW265.32 g/mol
LogP0.85
Rot. Bonds7

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

1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine (PubChem CID 77078626) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is 1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine.

Molecular Properties

Compound Name1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine
PubChem CID77078626
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Name1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine
SMILESCOCCn1ccnc1CN(C)Cc1nnc(C)o1
InChIInChI=1S/C12H19N5O2/c1-10-14-15-12(19-10)9-16(2)8-11-13-4-5-17(11)6-7-18-3/h4-5H,6-9H2,1-3H3
InChIKeyGKDQIUXGOQLCTR-UHFFFAOYSA-N
XLogP0.85
TPSA69.21 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 50.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine?
The IUPAC name of 1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine (CID 77078626) is 1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine.
What is the SMILES notation for 1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine?
The canonical SMILES for 1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine is COCCn1ccnc1CN(C)Cc1nnc(C)o1.
What is the InChIKey of 1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine?
The InChIKey is GKDQIUXGOQLCTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-10-14-15-12(19-10)9-16(2)8-11-13-4-5-17(11)6-7-18-3/h4-5H,6-9H2,1-3H3.
What are the key properties of 1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine?
1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine has a molecular weight of 265.32 g/mol, XLogP of 0.85, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methoxyethyl)imidazol-2-yl]-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine is sourced from PubChem (CID 77078626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).