N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine

C10H10N4O2 — CID 2123287

IUPACN-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine
SMILESc1coc(-c2nnc(NC3=NCCC3)o2)c1
InChIInChI=1S/C10H10N4O2/c1-4-8(11-5-1)12-10-14-13-9(16-10)7-3-2-6-15-7/h2-3,6H,1,4-5H2,(H,11,12,14)
InChIKeyVMGYZKHFZRVYEU-UHFFFAOYSA-N
MW218.22 g/mol
LogP1.93
Rot. Bonds2

About N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine

N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine (PubChem CID 2123287) has the molecular formula C10H10N4O2 and a molecular weight of 218.22 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine
PubChem CID2123287
Molecular FormulaC10H10N4O2
Molecular Weight218.22 g/mol
Exact Mass218.08
IUPAC NameN-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine
SMILESc1coc(-c2nnc(NC3=NCCC3)o2)c1
InChIInChI=1S/C10H10N4O2/c1-4-8(11-5-1)12-10-14-13-9(16-10)7-3-2-6-15-7/h2-3,6H,1,4-5H2,(H,11,12,14)
InChIKeyVMGYZKHFZRVYEU-UHFFFAOYSA-N
XLogP1.93
TPSA76.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(Furan-2-yl)-1,3,4-oxadiazol-2-amine
CID 202185
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]pentanamide
CID 4062264
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-phenylacetamide
CID 4154351
N-(5-(furan-2-yl)-1,3,4-oxadiazol-2-yl)cyclopropanecarboxamide
CID 4536914
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-phenoxyacetamide
CID 4581041
N-(5-(furan-2-yl)-1,3,4-oxadiazol-2-yl)cinnamamide
CID 6265754
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]acetamide
CID 4245856
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]propanamide
CID 4536915
2-{[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 3147356
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]cyclohexanecarboxamide
CID 5147586
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide
CID 4228042
N-(5-(furan-2-yl)-1,3,4-oxadiazol-2-yl)-5,6-dihydro-1,4-dioxine-2-carboxamide
CID 4423483

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine?
The IUPAC name of N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine (CID 2123287) is N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine?
The canonical SMILES for N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine is c1coc(-c2nnc(NC3=NCCC3)o2)c1.
What is the InChIKey of N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine?
The InChIKey is VMGYZKHFZRVYEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2/c1-4-8(11-5-1)12-10-14-13-9(16-10)7-3-2-6-15-7/h2-3,6H,1,4-5H2,(H,11,12,14).
What are the key properties of N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine?
N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine has a molecular weight of 218.22 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-pyrrol-5-yl)-5-(furan-2-yl)-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 2123287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).