6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine

C5H8ClN5S — CID 12926761

IUPAC6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine
SMILESCSc1c(N)nc(NN)nc1Cl
InChIInChI=1S/C5H8ClN5S/c1-12-2-3(6)9-5(11-8)10-4(2)7/h8H2,1H3,(H3,7,9,10,11)
InChIKeyYZKPRUSKYSXLNH-UHFFFAOYSA-N
MW205.67 g/mol
LogP0.72
Rot. Bonds2

About 6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine

6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine (PubChem CID 12926761) has the molecular formula C5H8ClN5S and a molecular weight of 205.67 g/mol. Its IUPAC name is 6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine
PubChem CID12926761
Molecular FormulaC5H8ClN5S
Molecular Weight205.67 g/mol
Exact Mass205.02
IUPAC Name6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine
SMILESCSc1c(N)nc(NN)nc1Cl
InChIInChI=1S/C5H8ClN5S/c1-12-2-3(6)9-5(11-8)10-4(2)7/h8H2,1H3,(H3,7,9,10,11)
InChIKeyYZKPRUSKYSXLNH-UHFFFAOYSA-N
XLogP0.72
TPSA89.85 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.67
LogP ≤ 50.72
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'}

Analyze 6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Ukj 72J
CID 124699
Tioclorim
CID 50262
2-Chloro-5-(methylthio)-4,6-pyrimidinediamine
CID 51216
4-Chloro-5-fluoro-6-hydrazino-2-(methylthio)pyrimidine
CID 86636914
6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine
CID 54265
6-Chloro-5-methylsulfinylpyrimidine-2,4-diamine
CID 12790359
6-chloro-2-N-methyl-5-methylsulfinylpyrimidine-2,4-diamine
CID 12790365
(2,6-Dichloro-5-methylsulfanylpyrimidin-4-yl)hydrazine
CID 12926756
4,6-Dichloro-2-hydrazinyl-5-(methylthio)pyrimidine
CID 12926757
4,6-Dichloro-5-methylsulfanylpyrimidin-2-amine
CID 12926758
2,6-Dichloro-5-methylsulfanylpyrimidin-4-amine
CID 12926759
4-Chloro-6-hydrazinyl-5-methylsulfanylpyrimidin-2-amine
CID 12926760

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine?
The IUPAC name of 6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine (CID 12926761) is 6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine.
What is the SMILES notation for 6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine?
The canonical SMILES for 6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine is CSc1c(N)nc(NN)nc1Cl.
What is the InChIKey of 6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine?
The InChIKey is YZKPRUSKYSXLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8ClN5S/c1-12-2-3(6)9-5(11-8)10-4(2)7/h8H2,1H3,(H3,7,9,10,11).
What are the key properties of 6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine?
6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine has a molecular weight of 205.67 g/mol, XLogP of 0.72, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine is sourced from PubChem (CID 12926761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).