(E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine

C7H11N3 — CID 177189487

IUPAC(E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine
SMILESCC/C=c1/nc[nH]/c1=C/N
InChIInChI=1S/C7H11N3/c1-2-3-6-7(4-8)10-5-9-6/h3-5H,2,8H2,1H3,(H,9,10)/b6-3+,7-4+
InChIKeyAVGZOZUYTRIPSS-XOKGJFMYSA-N
MW137.19 g/mol
LogP-0.70
Rot. Bonds1

About (E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine

(E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine (PubChem CID 177189487) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is (E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine.

Molecular Properties

Compound Name(E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine
PubChem CID177189487
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name(E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine
SMILESCC/C=c1/nc[nH]/c1=C/N
InChIInChI=1S/C7H11N3/c1-2-3-6-7(4-8)10-5-9-6/h3-5H,2,8H2,1H3,(H,9,10)/b6-3+,7-4+
InChIKeyAVGZOZUYTRIPSS-XOKGJFMYSA-N
XLogP-0.70
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 5-0.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine?
The IUPAC name of (E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine (CID 177189487) is (E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine.
What is the SMILES notation for (E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine?
The canonical SMILES for (E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine is CC/C=c1/nc[nH]/c1=C/N.
What is the InChIKey of (E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine?
The InChIKey is AVGZOZUYTRIPSS-XOKGJFMYSA-N. The full InChI is InChI=1S/C7H11N3/c1-2-3-6-7(4-8)10-5-9-6/h3-5H,2,8H2,1H3,(H,9,10)/b6-3+,7-4+.
What are the key properties of (E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine?
(E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine has a molecular weight of 137.19 g/mol, XLogP of -0.70, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine is sourced from PubChem (CID 177189487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).