[(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine

C19H24N4O3 — CID 87276405

IUPAC[(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine
SMILESCOc1cc(C(=NN)C2CNC(c3ccccc3)N2)cc(OC)c1OC
InChIInChI=1S/C19H24N4O3/c1-24-15-9-13(10-16(25-2)18(15)26-3)17(23-20)14-11-21-19(22-14)12-7-5-4-6-8-12/h4-10,14,19,21-22H,11,20H2,1-3H3
InChIKeyFRYNXNNNGAWGFU-UHFFFAOYSA-N
MW356.43 g/mol
LogP1.64
Rot. Bonds6

About [(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine

[(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine (PubChem CID 87276405) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is [(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine.

Molecular Properties

Compound Name[(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine
PubChem CID87276405
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC Name[(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine
SMILESCOc1cc(C(=NN)C2CNC(c3ccccc3)N2)cc(OC)c1OC
InChIInChI=1S/C19H24N4O3/c1-24-15-9-13(10-16(25-2)18(15)26-3)17(23-20)14-11-21-19(22-14)12-7-5-4-6-8-12/h4-10,14,19,21-22H,11,20H2,1-3H3
InChIKeyFRYNXNNNGAWGFU-UHFFFAOYSA-N
XLogP1.64
TPSA90.13 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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 [(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine?
The IUPAC name of [(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine (CID 87276405) is [(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine.
What is the SMILES notation for [(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine?
The canonical SMILES for [(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine is COc1cc(C(=NN)C2CNC(c3ccccc3)N2)cc(OC)c1OC.
What is the InChIKey of [(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine?
The InChIKey is FRYNXNNNGAWGFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-24-15-9-13(10-16(25-2)18(15)26-3)17(23-20)14-11-21-19(22-14)12-7-5-4-6-8-12/h4-10,14,19,21-22H,11,20H2,1-3H3.
What are the key properties of [(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine?
[(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine has a molecular weight of 356.43 g/mol, XLogP of 1.64, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-phenylimidazolidin-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]hydrazine is sourced from PubChem (CID 87276405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).