(E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine

C10H14N4 — CID 89263320

IUPAC(E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine
SMILESC=C/C=C1/C(C(C)C)=NC=N/C1=N/N
InChIInChI=1S/C10H14N4/c1-4-5-8-9(7(2)3)12-6-13-10(8)14-11/h4-7H,1,11H2,2-3H3/b8-5-,14-10+
InChIKeyUVKLBDPVLISVBD-IOBBEBRSSA-N
MW190.25 g/mol
LogP1.51
Rot. Bonds2

About (E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine

(E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine (PubChem CID 89263320) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is (E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine.

Molecular Properties

Compound Name(E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine
PubChem CID89263320
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name(E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine
SMILESC=C/C=C1/C(C(C)C)=NC=N/C1=N/N
InChIInChI=1S/C10H14N4/c1-4-5-8-9(7(2)3)12-6-13-10(8)14-11/h4-7H,1,11H2,2-3H3/b8-5-,14-10+
InChIKeyUVKLBDPVLISVBD-IOBBEBRSSA-N
XLogP1.51
TPSA63.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine?
The IUPAC name of (E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine (CID 89263320) is (E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine.
What is the SMILES notation for (E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine?
The canonical SMILES for (E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine is C=C/C=C1/C(C(C)C)=NC=N/C1=N/N.
What is the InChIKey of (E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine?
The InChIKey is UVKLBDPVLISVBD-IOBBEBRSSA-N. The full InChI is InChI=1S/C10H14N4/c1-4-5-8-9(7(2)3)12-6-13-10(8)14-11/h4-7H,1,11H2,2-3H3/b8-5-,14-10+.
What are the key properties of (E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine?
(E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine has a molecular weight of 190.25 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-[(5Z)-6-propan-2-yl-5-prop-2-enylidenepyrimidin-4-ylidene]hydrazine is sourced from PubChem (CID 89263320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).