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

C10H18N4O — CID 106968742

IUPAC5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine
SMILESCCCN(C)c1nnc(CNC2CC2)o1
InChIInChI=1S/C10H18N4O/c1-3-6-14(2)10-13-12-9(15-10)7-11-8-4-5-8/h8,11H,3-7H2,1-2H3
InChIKeyITTDUCNEPOPACP-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.17
Rot. Bonds6

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

5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine (PubChem CID 106968742) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine
PubChem CID106968742
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine
SMILESCCCN(C)c1nnc(CNC2CC2)o1
InChIInChI=1S/C10H18N4O/c1-3-6-14(2)10-13-12-9(15-10)7-11-8-4-5-8/h8,11H,3-7H2,1-2H3
InChIKeyITTDUCNEPOPACP-UHFFFAOYSA-N
XLogP1.17
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.17
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-methyl-N-propyl-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine (CID 106968742) is 5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine is CCCN(C)c1nnc(CNC2CC2)o1.
What is the InChIKey of 5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine?
The InChIKey is ITTDUCNEPOPACP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-3-6-14(2)10-13-12-9(15-10)7-11-8-4-5-8/h8,11H,3-7H2,1-2H3.
What are the key properties of 5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine?
5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine has a molecular weight of 210.28 g/mol, XLogP of 1.17, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 106968742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).