N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine

C14H19N5 — CID 114250739

IUPACN-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine
SMILESCCc1ccc(Nc2nc(NN)ncc2C)cc1C
InChIInChI=1S/C14H19N5/c1-4-11-5-6-12(7-9(11)2)17-13-10(3)8-16-14(18-13)19-15/h5-8H,4,15H2,1-3H3,(H2,16,17,18,19)
InChIKeyFELOFPXZVZMEDZ-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.69
Rot. Bonds4

About N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine

N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine (PubChem CID 114250739) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine
PubChem CID114250739
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC NameN-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine
SMILESCCc1ccc(Nc2nc(NN)ncc2C)cc1C
InChIInChI=1S/C14H19N5/c1-4-11-5-6-12(7-9(11)2)17-13-10(3)8-16-14(18-13)19-15/h5-8H,4,15H2,1-3H3,(H2,16,17,18,19)
InChIKeyFELOFPXZVZMEDZ-UHFFFAOYSA-N
XLogP2.69
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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 N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine?
The IUPAC name of N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine (CID 114250739) is N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine.
What is the SMILES notation for N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine?
The canonical SMILES for N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine is CCc1ccc(Nc2nc(NN)ncc2C)cc1C.
What is the InChIKey of N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine?
The InChIKey is FELOFPXZVZMEDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-4-11-5-6-12(7-9(11)2)17-13-10(3)8-16-14(18-13)19-15/h5-8H,4,15H2,1-3H3,(H2,16,17,18,19).
What are the key properties of N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine?
N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine has a molecular weight of 257.34 g/mol, XLogP of 2.69, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-3-methylphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine is sourced from PubChem (CID 114250739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).