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

C6H10ClN5S — CID 12926768

IUPAC4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine
SMILESCNc1nc(Cl)c(SC)c(NN)n1
InChIInChI=1S/C6H10ClN5S/c1-9-6-10-4(7)3(13-2)5(11-6)12-8/h8H2,1-2H3,(H2,9,10,11,12)
InChIKeyBKUOFZVWKOZDQO-UHFFFAOYSA-N
MW219.70 g/mol
LogP1.18
Rot. Bonds3

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

4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine (PubChem CID 12926768) has the molecular formula C6H10ClN5S and a molecular weight of 219.70 g/mol. Its IUPAC name is 4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine.

Molecular Properties

Compound Name4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine
PubChem CID12926768
Molecular FormulaC6H10ClN5S
Molecular Weight219.70 g/mol
Exact Mass219.03
IUPAC Name4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine
SMILESCNc1nc(Cl)c(SC)c(NN)n1
InChIInChI=1S/C6H10ClN5S/c1-9-6-10-4(7)3(13-2)5(11-6)12-8/h8H2,1-2H3,(H2,9,10,11,12)
InChIKeyBKUOFZVWKOZDQO-UHFFFAOYSA-N
XLogP1.18
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.70
LogP ≤ 51.18
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

N~4~-butyl-6-chloro-N~2~-methyl-5-(methylsulfanyl)-2,4-pyrimidinediamine
CID 2765582
Ukj 72J
CID 124699
Tioclorim
CID 50262
6-chloro-5-fluoro-N-methyl-2-(2-methylhydrazinyl)pyrimidin-4-amine
CID 143803922
4,6-dichloro-N-methyl-5-(methylsulfanyl)-2-pyrimidinamine
CID 1488580
6-chloro-2-N-ethyl-5-methylsulfinylpyrimidine-2,4-diamine
CID 12790361
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-Chloro-6-hydrazinyl-5-methylsulfanylpyrimidin-2-amine
CID 12926760
6-Chloro-2-hydrazinyl-5-methylsulfanylpyrimidin-4-amine
CID 12926761
4-Azido-6-chloro-5-methylsulfanylpyrimidin-2-amine
CID 12926764

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine?
The IUPAC name of 4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine (CID 12926768) is 4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine.
What is the SMILES notation for 4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine?
The canonical SMILES for 4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine is CNc1nc(Cl)c(SC)c(NN)n1.
What is the InChIKey of 4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine?
The InChIKey is BKUOFZVWKOZDQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10ClN5S/c1-9-6-10-4(7)3(13-2)5(11-6)12-8/h8H2,1-2H3,(H2,9,10,11,12).
What are the key properties of 4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine?
4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine has a molecular weight of 219.70 g/mol, XLogP of 1.18, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-hydrazinyl-N-methyl-5-methylsulfanylpyrimidin-2-amine is sourced from PubChem (CID 12926768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).