4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide

C16H19N3O2 — CID 63211606

IUPAC4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide
SMILESCc1cc(C(=O)NCCc2ccc(O)cc2)ccc1NN
InChIInChI=1S/C16H19N3O2/c1-11-10-13(4-7-15(11)19-17)16(21)18-9-8-12-2-5-14(20)6-3-12/h2-7,10,19-20H,8-9,17H2,1H3,(H,18,21)
InChIKeyUEVNVXPQCWBKEL-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.96
Rot. Bonds5

About 4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide

4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide (PubChem CID 63211606) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide.

Molecular Properties

Compound Name4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide
PubChem CID63211606
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide
SMILESCc1cc(C(=O)NCCc2ccc(O)cc2)ccc1NN
InChIInChI=1S/C16H19N3O2/c1-11-10-13(4-7-15(11)19-17)16(21)18-9-8-12-2-5-14(20)6-3-12/h2-7,10,19-20H,8-9,17H2,1H3,(H,18,21)
InChIKeyUEVNVXPQCWBKEL-UHFFFAOYSA-N
XLogP1.96
TPSA87.38 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.96
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide?
The IUPAC name of 4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide (CID 63211606) is 4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide.
What is the SMILES notation for 4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide?
The canonical SMILES for 4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide is Cc1cc(C(=O)NCCc2ccc(O)cc2)ccc1NN.
What is the InChIKey of 4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide?
The InChIKey is UEVNVXPQCWBKEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-11-10-13(4-7-15(11)19-17)16(21)18-9-8-12-2-5-14(20)6-3-12/h2-7,10,19-20H,8-9,17H2,1H3,(H,18,21).
What are the key properties of 4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide?
4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide has a molecular weight of 285.35 g/mol, XLogP of 1.96, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-[2-(4-hydroxyphenyl)ethyl]-3-methylbenzamide is sourced from PubChem (CID 63211606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).