6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine

C14H19N5 — CID 80894168

IUPAC6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine
SMILESCCCc1ccc(Nc2ncnc(NN)c2C)cc1
InChIInChI=1S/C14H19N5/c1-3-4-11-5-7-12(8-6-11)18-13-10(2)14(19-15)17-9-16-13/h5-9H,3-4,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyXIEIMLFLDPUHTQ-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.77
Rot. Bonds5

About 6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine

6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine (PubChem CID 80894168) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is 6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine
PubChem CID80894168
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC Name6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine
SMILESCCCc1ccc(Nc2ncnc(NN)c2C)cc1
InChIInChI=1S/C14H19N5/c1-3-4-11-5-7-12(8-6-11)18-13-10(2)14(19-15)17-9-16-13/h5-9H,3-4,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyXIEIMLFLDPUHTQ-UHFFFAOYSA-N
XLogP2.77
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.77
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 6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine (CID 80894168) is 6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine is CCCc1ccc(Nc2ncnc(NN)c2C)cc1.
What is the InChIKey of 6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine?
The InChIKey is XIEIMLFLDPUHTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-3-4-11-5-7-12(8-6-11)18-13-10(2)14(19-15)17-9-16-13/h5-9H,3-4,15H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine?
6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine has a molecular weight of 257.34 g/mol, XLogP of 2.77, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-5-methyl-N-(4-propylphenyl)pyrimidin-4-amine is sourced from PubChem (CID 80894168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).