6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine

C14H19N5S — CID 107647320

IUPAC6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine
SMILESCSc1ccccc1Nc1cc(NN)nc(C(C)C)n1
InChIInChI=1S/C14H19N5S/c1-9(2)14-17-12(8-13(18-14)19-15)16-10-6-4-5-7-11(10)20-3/h4-9H,15H2,1-3H3,(H2,16,17,18,19)
InChIKeyYSDZPIBRPVVTHL-UHFFFAOYSA-N
MW289.41 g/mol
LogP3.35
Rot. Bonds5

About 6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine

6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine (PubChem CID 107647320) has the molecular formula C14H19N5S and a molecular weight of 289.41 g/mol. Its IUPAC name is 6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine
PubChem CID107647320
Molecular FormulaC14H19N5S
Molecular Weight289.41 g/mol
Exact Mass289.14
IUPAC Name6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine
SMILESCSc1ccccc1Nc1cc(NN)nc(C(C)C)n1
InChIInChI=1S/C14H19N5S/c1-9(2)14-17-12(8-13(18-14)19-15)16-10-6-4-5-7-11(10)20-3/h4-9H,15H2,1-3H3,(H2,16,17,18,19)
InChIKeyYSDZPIBRPVVTHL-UHFFFAOYSA-N
XLogP3.35
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.41
LogP ≤ 53.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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-(2-methylsulfanylphenyl)pyridin-2-amine
CID 107647318
6-hydrazinyl-N-(3-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine
CID 80969003
N-(2,6-dichlorophenyl)-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80969189
N-(5-chloro-2-methylphenyl)-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80968585
5-fluoro-2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)amino]benzonitrile
CID 82682481
1-N-(6-hydrazinyl-2-methylsulfanylpyrimidin-4-yl)-2-N,2-N-dimethylbenzene-1,2-diamine
CID 106761138
N-[1-(2-fluorophenyl)ethyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80964999
1-N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-4-N,4-N-dimethylbenzene-1,4-diamine
CID 80962948
2-cyclopropyl-6-hydrazinyl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine
CID 80968890
6-N-(2-methylsulfanylphenyl)pyridine-2,6-diamine
CID 107647058
N-cyclopropyl-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80968411
6-chloro-2-propan-2-yl-N-(2-propan-2-ylphenyl)pyrimidin-4-amine
CID 80949167

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine (CID 107647320) is 6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine is CSc1ccccc1Nc1cc(NN)nc(C(C)C)n1.
What is the InChIKey of 6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is YSDZPIBRPVVTHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5S/c1-9(2)14-17-12(8-13(18-14)19-15)16-10-6-4-5-7-11(10)20-3/h4-9H,15H2,1-3H3,(H2,16,17,18,19).
What are the key properties of 6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine?
6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 289.41 g/mol, XLogP of 3.35, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(2-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 107647320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).