6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine

C16H23N5 — CID 80924181

IUPAC6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1c(NN)ncnc1N(C)CCc1ccccc1
InChIInChI=1S/C16H23N5/c1-12(2)14-15(20-17)18-11-19-16(14)21(3)10-9-13-7-5-4-6-8-13/h4-8,11-12H,9-10,17H2,1-3H3,(H,18,19,20)
InChIKeyXSDNURXCRXBHAP-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.56
Rot. Bonds6

About 6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine

6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine (PubChem CID 80924181) has the molecular formula C16H23N5 and a molecular weight of 285.39 g/mol. Its IUPAC name is 6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine
PubChem CID80924181
Molecular FormulaC16H23N5
Molecular Weight285.39 g/mol
Exact Mass285.20
IUPAC Name6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1c(NN)ncnc1N(C)CCc1ccccc1
InChIInChI=1S/C16H23N5/c1-12(2)14-15(20-17)18-11-19-16(14)21(3)10-9-13-7-5-4-6-8-13/h4-8,11-12H,9-10,17H2,1-3H3,(H,18,19,20)
InChIKeyXSDNURXCRXBHAP-UHFFFAOYSA-N
XLogP2.56
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.56
H-Bond Donors ≤ 52
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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Related Compounds

6-hydrazinyl-N-methyl-5-propan-2-yl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 80911233
6-hydrazinyl-N,N-bis(2-methylpropyl)-5-propan-2-ylpyrimidin-4-amine
CID 80898611
6-hydrazinyl-N-methyl-5-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine
CID 80899159
N'-(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 80901295
N-benzyl-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine
CID 80917919
2-[ethyl-(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]ethanol
CID 80899078
N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propan-2-ylpyrimidin-4-amine
CID 80906631
3-[(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)-methylamino]benzonitrile
CID 80904964
4-[[(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)-methylamino]methyl]oxan-4-ol
CID 114954262
N-(2-ethoxyethyl)-N-ethyl-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine
CID 80909764
6-hydrazinyl-5-propan-2-yl-N-(2-propylphenyl)pyrimidin-4-amine
CID 80901927
3-[(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)-propan-2-ylamino]propanenitrile
CID 80905468

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine (CID 80924181) is 6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine is CC(C)c1c(NN)ncnc1N(C)CCc1ccccc1.
What is the InChIKey of 6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine?
The InChIKey is XSDNURXCRXBHAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5/c1-12(2)14-15(20-17)18-11-19-16(14)21(3)10-9-13-7-5-4-6-8-13/h4-8,11-12H,9-10,17H2,1-3H3,(H,18,19,20).
What are the key properties of 6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine?
6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine has a molecular weight of 285.39 g/mol, XLogP of 2.56, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-methyl-N-(2-phenylethyl)-5-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80924181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).