(3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine

C10H16N4S — CID 106973343

IUPAC(3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine
SMILESCSc1cc(N2CCC[C@@H](N)C2)ncn1
InChIInChI=1S/C10H16N4S/c1-15-10-5-9(12-7-13-10)14-4-2-3-8(11)6-14/h5,7-8H,2-4,6,11H2,1H3/t8-/m1/s1
InChIKeyDDDWDVBGVCNQAN-MRVPVSSYSA-N
MW224.33 g/mol
LogP1.13
Rot. Bonds2

About (3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine

(3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine (PubChem CID 106973343) has the molecular formula C10H16N4S and a molecular weight of 224.33 g/mol. Its IUPAC name is (3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine.

Molecular Properties

Compound Name(3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine
PubChem CID106973343
Molecular FormulaC10H16N4S
Molecular Weight224.33 g/mol
Exact Mass224.11
IUPAC Name(3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine
SMILESCSc1cc(N2CCC[C@@H](N)C2)ncn1
InChIInChI=1S/C10H16N4S/c1-15-10-5-9(12-7-13-10)14-4-2-3-8(11)6-14/h5,7-8H,2-4,6,11H2,1H3/t8-/m1/s1
InChIKeyDDDWDVBGVCNQAN-MRVPVSSYSA-N
XLogP1.13
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(4-chloro-3-methylpiperidin-1-yl)-6-methylsulfanylpyrimidine
CID 106973827
6-(3-aminopiperidin-1-yl)-N,N-dimethylpyrimidin-4-amine
CID 53185813
4-methyl-1-(6-methylsulfanylpyrimidin-4-yl)pyrrolidin-3-amine
CID 106973347
2-methyl-N-[[1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-yl]methyl]propan-1-amine
CID 106973651
N-methyl-1-(6-methylsulfanylpyrimidin-4-yl)pyrrolidin-3-amine
CID 106973300
6-[(3R)-3-aminopiperidin-1-yl]-N,N-diethylpyrimidin-4-amine
CID 86318094
1-(6-propoxypyrimidin-4-yl)piperidin-3-amine
CID 66333796
4-(4-bromopiperidin-1-yl)-6-methylsulfanylpyrimidine
CID 106973777
N-[[1-(6-methylsulfanylpyrimidin-4-yl)piperidin-4-yl]methyl]ethanamine
CID 106973293
1-(6-piperidin-1-ylpyrimidin-4-yl)azetidin-3-amine
CID 174573496
4-cyclopropyl-6-[3-(methylsulfanylmethyl)piperidin-1-yl]pyrimidine
CID 72839959
[4-(6-methylsulfanylpyrimidin-4-yl)morpholin-2-yl]methanol
CID 106973462

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine?
The IUPAC name of (3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine (CID 106973343) is (3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine.
What is the SMILES notation for (3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine?
The canonical SMILES for (3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine is CSc1cc(N2CCC[C@@H](N)C2)ncn1.
What is the InChIKey of (3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine?
The InChIKey is DDDWDVBGVCNQAN-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H16N4S/c1-15-10-5-9(12-7-13-10)14-4-2-3-8(11)6-14/h5,7-8H,2-4,6,11H2,1H3/t8-/m1/s1.
What are the key properties of (3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine?
(3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine has a molecular weight of 224.33 g/mol, XLogP of 1.13, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine is sourced from PubChem (CID 106973343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).