(2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine

C8H15N5 — CID 145331125

IUPAC(2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine
SMILESCN1CCN(N)/C(=C2/CN=CN2)C1
InChIInChI=1S/C8H15N5/c1-12-2-3-13(9)8(5-12)7-4-10-6-11-7/h6H,2-5,9H2,1H3,(H,10,11)/b8-7-
InChIKeyWCCJHDZCEKTNBL-FPLPWBNLSA-N
MW181.24 g/mol
LogP-1.05
Rot. Bonds

About (2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine

(2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine (PubChem CID 145331125) has the molecular formula C8H15N5 and a molecular weight of 181.24 g/mol. Its IUPAC name is (2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine.

Molecular Properties

Compound Name(2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine
PubChem CID145331125
Molecular FormulaC8H15N5
Molecular Weight181.24 g/mol
Exact Mass181.13
IUPAC Name(2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine
SMILESCN1CCN(N)/C(=C2/CN=CN2)C1
InChIInChI=1S/C8H15N5/c1-12-2-3-13(9)8(5-12)7-4-10-6-11-7/h6H,2-5,9H2,1H3,(H,10,11)/b8-7-
InChIKeyWCCJHDZCEKTNBL-FPLPWBNLSA-N
XLogP-1.05
TPSA56.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 5-1.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine?
The IUPAC name of (2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine (CID 145331125) is (2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine.
What is the SMILES notation for (2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine?
The canonical SMILES for (2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine is CN1CCN(N)/C(=C2/CN=CN2)C1.
What is the InChIKey of (2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine?
The InChIKey is WCCJHDZCEKTNBL-FPLPWBNLSA-N. The full InChI is InChI=1S/C8H15N5/c1-12-2-3-13(9)8(5-12)7-4-10-6-11-7/h6H,2-5,9H2,1H3,(H,10,11)/b8-7-.
What are the key properties of (2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine?
(2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine has a molecular weight of 181.24 g/mol, XLogP of -1.05, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(1,4-dihydroimidazol-5-ylidene)-4-methylpiperazin-1-amine is sourced from PubChem (CID 145331125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).