5-amino-6-methyl-1H-pyrimidine-4-thione;methane

C6H11N3S — CID 143110415

IUPAC5-amino-6-methyl-1H-pyrimidine-4-thione;methane
SMILESC.Cc1[nH]cnc(=S)c1N
InChIInChI=1S/C5H7N3S.CH4/c1-3-4(6)5(9)8-2-7-3;/h2H,6H2,1H3,(H,7,8,9);1H4
InChIKeyCWAUBZPYRGRFAC-UHFFFAOYSA-N
MW157.24 g/mol
LogP1.67
Rot. Bonds

About 5-amino-6-methyl-1H-pyrimidine-4-thione;methane

5-amino-6-methyl-1H-pyrimidine-4-thione;methane (PubChem CID 143110415) has the molecular formula C6H11N3S and a molecular weight of 157.24 g/mol. Its IUPAC name is 5-amino-6-methyl-1H-pyrimidine-4-thione;methane.

Molecular Properties

Compound Name5-amino-6-methyl-1H-pyrimidine-4-thione;methane
PubChem CID143110415
Molecular FormulaC6H11N3S
Molecular Weight157.24 g/mol
Exact Mass157.07
IUPAC Name5-amino-6-methyl-1H-pyrimidine-4-thione;methane
SMILESC.Cc1[nH]cnc(=S)c1N
InChIInChI=1S/C5H7N3S.CH4/c1-3-4(6)5(9)8-2-7-3;/h2H,6H2,1H3,(H,7,8,9);1H4
InChIKeyCWAUBZPYRGRFAC-UHFFFAOYSA-N
XLogP1.67
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze 5-amino-6-methyl-1H-pyrimidine-4-thione;methane 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

6-Methyl-3,4-dihydropyrimidine-4-thione
CID 4557596
5-[fluoro(methyl)amino]-6-methyl-1H-pyrimidine-4-thione
CID 145504690
5-Fluoro-6-methylpyrimidine-4-thiol
CID 108150601
5-amino-6-methylpyrimidine-4(1H)-thione
CID 3887703
5-chloro-6-methyl-1H-pyrimidine-4-thione
CID 11062685
5,6-dimethyl-1H-pyrimidine-4-thione
CID 45071758
N,6-dimethyl-1,4-dihydropyrimidin-5-amine
CID 89418734
5-(ethylamino)-6-methyl-1H-pyrimidine-4-thione
CID 117913523
5-iodo-6-methyl-1H-pyrimidine-4-thione
CID 141809471
6-Methyl-1,4-dihydropyrimidin-5-amine
CID 142030297
5-amino-6-methyl-1H-pyrimidine-4-thione;ethane
CID 144396145
ethane;6-methyl-1H-pyrimidine-4-thione
CID 145330357

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-methyl-1H-pyrimidine-4-thione;methane?
The IUPAC name of 5-amino-6-methyl-1H-pyrimidine-4-thione;methane (CID 143110415) is 5-amino-6-methyl-1H-pyrimidine-4-thione;methane.
What is the SMILES notation for 5-amino-6-methyl-1H-pyrimidine-4-thione;methane?
The canonical SMILES for 5-amino-6-methyl-1H-pyrimidine-4-thione;methane is C.Cc1[nH]cnc(=S)c1N.
What is the InChIKey of 5-amino-6-methyl-1H-pyrimidine-4-thione;methane?
The InChIKey is CWAUBZPYRGRFAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3S.CH4/c1-3-4(6)5(9)8-2-7-3;/h2H,6H2,1H3,(H,7,8,9);1H4.
What are the key properties of 5-amino-6-methyl-1H-pyrimidine-4-thione;methane?
5-amino-6-methyl-1H-pyrimidine-4-thione;methane has a molecular weight of 157.24 g/mol, XLogP of 1.67, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-methyl-1H-pyrimidine-4-thione;methane is sourced from PubChem (CID 143110415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).