4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine

C9H9N3OS — CID 18507652

IUPAC4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine
SMILESCSc1cc(-c2ccco2)nc(N)n1
InChIInChI=1S/C9H9N3OS/c1-14-8-5-6(11-9(10)12-8)7-3-2-4-13-7/h2-5H,1H3,(H2,10,11,12)
InChIKeyYMOXQGMFVGIZIQ-UHFFFAOYSA-N
MW207.26 g/mol
LogP2.04
Rot. Bonds2

About 4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine

4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine (PubChem CID 18507652) has the molecular formula C9H9N3OS and a molecular weight of 207.26 g/mol. Its IUPAC name is 4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine
PubChem CID18507652
Molecular FormulaC9H9N3OS
Molecular Weight207.26 g/mol
Exact Mass207.05
IUPAC Name4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine
SMILESCSc1cc(-c2ccco2)nc(N)n1
InChIInChI=1S/C9H9N3OS/c1-14-8-5-6(11-9(10)12-8)7-3-2-4-13-7/h2-5H,1H3,(H2,10,11,12)
InChIKeyYMOXQGMFVGIZIQ-UHFFFAOYSA-N
XLogP2.04
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(furan-2-yl)-6-methylsulfanylpyridin-2-amine
CID 141045638
4-(furan-2-yl)-6-(4-phenylphenyl)pyrimidin-2-amine
CID 75360077
4-(furan-2-yl)-6-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine
CID 75360227
4-(2,5-dimethoxyphenyl)-6-(furan-2-yl)pyrimidin-2-amine
CID 75359770
4-(furan-2-yl)-6-(2-phenylethenyl)pyrimidin-2-amine
CID 70004554
2-amino-6-(furan-2-yl)-N-(2-methoxyethyl)pyrimidine-4-carboxamide
CID 11737091
2-chloro-6-(furan-2-yl)pyrimidin-4-amine
CID 66520852
5-ethyl-4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine
CID 18507240
4-N-[(4-bromophenyl)methyl]-6-(furan-2-yl)pyrimidine-2,4-diamine
CID 150817092
2-amino-6-(furan-2-yl)-4-methylsulfanylpyridine-3-carbonitrile;2,2,2-trifluoroacetic acid
CID 162311687
[2-amino-6-(furan-2-yl)pyrimidin-4-yl]-piperidin-1-ylmethanone
CID 11173320
2-amino-N-benzyl-6-(furan-2-yl)-N-methylpyrimidine-4-carboxamide
CID 59022943

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine?
The IUPAC name of 4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine (CID 18507652) is 4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine.
What is the SMILES notation for 4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine?
The canonical SMILES for 4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine is CSc1cc(-c2ccco2)nc(N)n1.
What is the InChIKey of 4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine?
The InChIKey is YMOXQGMFVGIZIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3OS/c1-14-8-5-6(11-9(10)12-8)7-3-2-4-13-7/h2-5H,1H3,(H2,10,11,12).
What are the key properties of 4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine?
4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine has a molecular weight of 207.26 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-amine is sourced from PubChem (CID 18507652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).