(4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine

C7H11N3 — CID 90836383

IUPAC(4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine
SMILESC/C=c1/nc(N)[nH]/c1=C/C
InChIInChI=1S/C7H11N3/c1-3-5-6(4-2)10-7(8)9-5/h3-4H,1-2H3,(H3,8,9,10)/b5-3+,6-4+
InChIKeyPQKZRHSAIVQHPV-GGWOSOGESA-N
MW137.19 g/mol
LogP-0.41
Rot. Bonds

About (4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine

(4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine (PubChem CID 90836383) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is (4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine.

Molecular Properties

Compound Name(4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine
PubChem CID90836383
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name(4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine
SMILESC/C=c1/nc(N)[nH]/c1=C/C
InChIInChI=1S/C7H11N3/c1-3-5-6(4-2)10-7(8)9-5/h3-4H,1-2H3,(H3,8,9,10)/b5-3+,6-4+
InChIKeyPQKZRHSAIVQHPV-GGWOSOGESA-N
XLogP-0.41
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine?
The IUPAC name of (4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine (CID 90836383) is (4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine.
What is the SMILES notation for (4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine?
The canonical SMILES for (4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine is C/C=c1/nc(N)[nH]/c1=C/C.
What is the InChIKey of (4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine?
The InChIKey is PQKZRHSAIVQHPV-GGWOSOGESA-N. The full InChI is InChI=1S/C7H11N3/c1-3-5-6(4-2)10-7(8)9-5/h3-4H,1-2H3,(H3,8,9,10)/b5-3+,6-4+.
What are the key properties of (4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine?
(4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine has a molecular weight of 137.19 g/mol, XLogP of -0.41, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,5E)-4,5-di(ethylidene)-1H-imidazol-2-amine is sourced from PubChem (CID 90836383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).