N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine

C11H15N5O — CID 80896852

IUPACN-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine
SMILESCC(Cc1ccco1)Nc1cncc(NN)n1
InChIInChI=1S/C11H15N5O/c1-8(5-9-3-2-4-17-9)14-10-6-13-7-11(15-10)16-12/h2-4,6-8H,5,12H2,1H3,(H2,14,15,16)
InChIKeyCRQFNSCAEPEVJO-UHFFFAOYSA-N
MW233.28 g/mol
LogP1.40
Rot. Bonds5

About N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine

N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine (PubChem CID 80896852) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine
PubChem CID80896852
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC NameN-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine
SMILESCC(Cc1ccco1)Nc1cncc(NN)n1
InChIInChI=1S/C11H15N5O/c1-8(5-9-3-2-4-17-9)14-10-6-13-7-11(15-10)16-12/h2-4,6-8H,5,12H2,1H3,(H2,14,15,16)
InChIKeyCRQFNSCAEPEVJO-UHFFFAOYSA-N
XLogP1.40
TPSA89.00 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine?
The IUPAC name of N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine (CID 80896852) is N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine.
What is the SMILES notation for N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine?
The canonical SMILES for N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine is CC(Cc1ccco1)Nc1cncc(NN)n1.
What is the InChIKey of N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine?
The InChIKey is CRQFNSCAEPEVJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-8(5-9-3-2-4-17-9)14-10-6-13-7-11(15-10)16-12/h2-4,6-8H,5,12H2,1H3,(H2,14,15,16).
What are the key properties of N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine?
N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine has a molecular weight of 233.28 g/mol, XLogP of 1.40, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)propan-2-yl]-6-hydrazinylpyrazin-2-amine is sourced from PubChem (CID 80896852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).