5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine

C8H14N4O — CID 82468411

IUPAC5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine
SMILESCN(C)c1nnc(CNC2CC2)o1
InChIInChI=1S/C8H14N4O/c1-12(2)8-11-10-7(13-8)5-9-6-3-4-6/h6,9H,3-5H2,1-2H3
InChIKeyOJFSPSCRLANGAI-UHFFFAOYSA-N
MW182.23 g/mol
LogP0.39
Rot. Bonds4

About 5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine

5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine (PubChem CID 82468411) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is 5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine
PubChem CID82468411
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC Name5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine
SMILESCN(C)c1nnc(CNC2CC2)o1
InChIInChI=1S/C8H14N4O/c1-12(2)8-11-10-7(13-8)5-9-6-3-4-6/h6,9H,3-5H2,1-2H3
InChIKeyOJFSPSCRLANGAI-UHFFFAOYSA-N
XLogP0.39
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine (CID 82468411) is 5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine is CN(C)c1nnc(CNC2CC2)o1.
What is the InChIKey of 5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine?
The InChIKey is OJFSPSCRLANGAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c1-12(2)8-11-10-7(13-8)5-9-6-3-4-6/h6,9H,3-5H2,1-2H3.
What are the key properties of 5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine?
5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine has a molecular weight of 182.23 g/mol, XLogP of 0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 82468411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).