5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine

C6H10N4 — CID 10820593

IUPAC5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine
SMILESNC/C=C/c1cnc(N)[nH]1
InChIInChI=1S/C6H10N4/c7-3-1-2-5-4-9-6(8)10-5/h1-2,4H,3,7H2,(H3,8,9,10)/b2-1+
InChIKeyYFJXNGUQXKFQAO-OWOJBTEDSA-N
MW138.17 g/mol
LogP-0.04
Rot. Bonds2

About 5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine

5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine (PubChem CID 10820593) has the molecular formula C6H10N4 and a molecular weight of 138.17 g/mol. Its IUPAC name is 5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine
PubChem CID10820593
Molecular FormulaC6H10N4
Molecular Weight138.17 g/mol
Exact Mass138.09
IUPAC Name5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine
SMILESNC/C=C/c1cnc(N)[nH]1
InChIInChI=1S/C6H10N4/c7-3-1-2-5-4-9-6(8)10-5/h1-2,4H,3,7H2,(H3,8,9,10)/b2-1+
InChIKeyYFJXNGUQXKFQAO-OWOJBTEDSA-N
XLogP-0.04
TPSA80.72 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 5-0.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine?
The IUPAC name of 5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine (CID 10820593) is 5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine.
What is the SMILES notation for 5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine?
The canonical SMILES for 5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine is NC/C=C/c1cnc(N)[nH]1.
What is the InChIKey of 5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine?
The InChIKey is YFJXNGUQXKFQAO-OWOJBTEDSA-N. The full InChI is InChI=1S/C6H10N4/c7-3-1-2-5-4-9-6(8)10-5/h1-2,4H,3,7H2,(H3,8,9,10)/b2-1+.
What are the key properties of 5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine?
5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine has a molecular weight of 138.17 g/mol, XLogP of -0.04, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(E)-3-aminoprop-1-enyl]-1H-imidazol-2-amine is sourced from PubChem (CID 10820593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).