N-ethenyl-4H-imidazol-5-amine

C5H7N3 — CID 67779644

IUPACN-ethenyl-4H-imidazol-5-amine
SMILESC=CNC1=NC=NC1
InChIInChI=1S/C5H7N3/c1-2-7-5-3-6-4-8-5/h2,4H,1,3H2,(H,6,7,8)
InChIKeyIEMAUWNVDRPLRM-UHFFFAOYSA-N
MW109.13 g/mol
LogP0.16
Rot. Bonds1

About N-ethenyl-4H-imidazol-5-amine

N-ethenyl-4H-imidazol-5-amine (PubChem CID 67779644) has the molecular formula C5H7N3 and a molecular weight of 109.13 g/mol. Its IUPAC name is N-ethenyl-4H-imidazol-5-amine.

Molecular Properties

Compound NameN-ethenyl-4H-imidazol-5-amine
PubChem CID67779644
Molecular FormulaC5H7N3
Molecular Weight109.13 g/mol
Exact Mass109.06
IUPAC NameN-ethenyl-4H-imidazol-5-amine
SMILESC=CNC1=NC=NC1
InChIInChI=1S/C5H7N3/c1-2-7-5-3-6-4-8-5/h2,4H,1,3H2,(H,6,7,8)
InChIKeyIEMAUWNVDRPLRM-UHFFFAOYSA-N
XLogP0.16
TPSA36.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.13
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-4H-imidazol-5-amine?
The IUPAC name of N-ethenyl-4H-imidazol-5-amine (CID 67779644) is N-ethenyl-4H-imidazol-5-amine.
What is the SMILES notation for N-ethenyl-4H-imidazol-5-amine?
The canonical SMILES for N-ethenyl-4H-imidazol-5-amine is C=CNC1=NC=NC1.
What is the InChIKey of N-ethenyl-4H-imidazol-5-amine?
The InChIKey is IEMAUWNVDRPLRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3/c1-2-7-5-3-6-4-8-5/h2,4H,1,3H2,(H,6,7,8).
What are the key properties of N-ethenyl-4H-imidazol-5-amine?
N-ethenyl-4H-imidazol-5-amine has a molecular weight of 109.13 g/mol, XLogP of 0.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-4H-imidazol-5-amine is sourced from PubChem (CID 67779644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).