2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine

C14H19N5 — CID 81006724

IUPAC2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine
SMILESCCc1nc(NN)c(C)c(Nc2ccccc2C)n1
InChIInChI=1S/C14H19N5/c1-4-12-17-13(10(3)14(18-12)19-15)16-11-8-6-5-7-9(11)2/h5-8H,4,15H2,1-3H3,(H2,16,17,18,19)
InChIKeyBNERPHUBZOFCTI-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.69
Rot. Bonds4

About 2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine

2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine (PubChem CID 81006724) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is 2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine
PubChem CID81006724
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC Name2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine
SMILESCCc1nc(NN)c(C)c(Nc2ccccc2C)n1
InChIInChI=1S/C14H19N5/c1-4-12-17-13(10(3)14(18-12)19-15)16-11-8-6-5-7-9(11)2/h5-8H,4,15H2,1-3H3,(H2,16,17,18,19)
InChIKeyBNERPHUBZOFCTI-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 2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine?
The IUPAC name of 2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine (CID 81006724) is 2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine?
The canonical SMILES for 2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine is CCc1nc(NN)c(C)c(Nc2ccccc2C)n1.
What is the InChIKey of 2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine?
The InChIKey is BNERPHUBZOFCTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-4-12-17-13(10(3)14(18-12)19-15)16-11-8-6-5-7-9(11)2/h5-8H,4,15H2,1-3H3,(H2,16,17,18,19).
What are the key properties of 2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine?
2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-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 2-ethyl-6-hydrazinyl-5-methyl-N-(2-methylphenyl)pyrimidin-4-amine is sourced from PubChem (CID 81006724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).