5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine

C7H10N6O2 — CID 106413138

IUPAC5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine
SMILESNCCc1nnc(NCc2ncon2)o1
InChIInChI=1S/C7H10N6O2/c8-2-1-6-11-12-7(15-6)9-3-5-10-4-14-13-5/h4H,1-3,8H2,(H,9,12)
InChIKeyNWALLRZJABAZEY-UHFFFAOYSA-N
MW210.20 g/mol
LogP-0.43
Rot. Bonds5

About 5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine

5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine (PubChem CID 106413138) has the molecular formula C7H10N6O2 and a molecular weight of 210.20 g/mol. Its IUPAC name is 5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine
PubChem CID106413138
Molecular FormulaC7H10N6O2
Molecular Weight210.20 g/mol
Exact Mass210.09
IUPAC Name5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine
SMILESNCCc1nnc(NCc2ncon2)o1
InChIInChI=1S/C7H10N6O2/c8-2-1-6-11-12-7(15-6)9-3-5-10-4-14-13-5/h4H,1-3,8H2,(H,9,12)
InChIKeyNWALLRZJABAZEY-UHFFFAOYSA-N
XLogP-0.43
TPSA115.89 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.20
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

2-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1,3,4-oxadiazole-2,5-diamine
CID 106413115
2-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3-benzoxazole-2,5-diamine
CID 106393409
5-(2-aminoethyl)-N-[[2-(trifluoromethyl)phenyl]methyl]-1,3,4-oxadiazol-2-amine
CID 106960559
3-N-(1,2,4-oxadiazol-3-ylmethyl)pyrazine-2,3-diamine
CID 106411526
5-(2-aminoethyl)-N-[2-(1,3-thiazol-4-yl)ethyl]-1,3,4-oxadiazol-2-amine
CID 106961342
3-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)-1,2,4-oxadiazol-5-amine
CID 106403164
5-(2-aminoethyl)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-1,3,4-oxadiazol-2-amine
CID 106425031
5-(1,2,4-oxadiazol-3-ylmethylamino)pyridine-2-carbothioamide
CID 106399667
5-(2-aminoethyl)-N-(2,2,3,3-tetrafluoropropyl)-1,3,4-oxadiazol-2-amine
CID 106296571
N-(1,2,4-oxadiazol-3-ylmethyl)-1,3-thiazol-2-amine
CID 106403375
5-(2-aminoethyl)-N-pyridazin-3-yl-1,3,4-oxadiazol-2-amine
CID 106965275
5-(2-aminoethyl)-N-[(4-ethylcyclohexyl)methyl]-1,3,4-oxadiazol-2-amine
CID 106959682

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine (CID 106413138) is 5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine is NCCc1nnc(NCc2ncon2)o1.
What is the InChIKey of 5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine?
The InChIKey is NWALLRZJABAZEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N6O2/c8-2-1-6-11-12-7(15-6)9-3-5-10-4-14-13-5/h4H,1-3,8H2,(H,9,12).
What are the key properties of 5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine?
5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine has a molecular weight of 210.20 g/mol, XLogP of -0.43, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-N-(1,2,4-oxadiazol-3-ylmethyl)-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 106413138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).