4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine

C15H21N5S — CID 124976453

IUPAC4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine
SMILESCC(C)N1CCCC[C@@H]1c1csc(Nc2ncccn2)n1
InChIInChI=1S/C15H21N5S/c1-11(2)20-9-4-3-6-13(20)12-10-21-15(18-12)19-14-16-7-5-8-17-14/h5,7-8,10-11,13H,3-4,6,9H2,1-2H3,(H,16,17,18,19)/t13-/m1/s1
InChIKeyLFNMHYAMCXXWNQ-CYBMUJFWSA-N
MW303.43 g/mol
LogP3.61
Rot. Bonds4

About 4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine

4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine (PubChem CID 124976453) has the molecular formula C15H21N5S and a molecular weight of 303.43 g/mol. Its IUPAC name is 4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine
PubChem CID124976453
Molecular FormulaC15H21N5S
Molecular Weight303.43 g/mol
Exact Mass303.15
IUPAC Name4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine
SMILESCC(C)N1CCCC[C@@H]1c1csc(Nc2ncccn2)n1
InChIInChI=1S/C15H21N5S/c1-11(2)20-9-4-3-6-13(20)12-10-21-15(18-12)19-14-16-7-5-8-17-14/h5,7-8,10-11,13H,3-4,6,9H2,1-2H3,(H,16,17,18,19)/t13-/m1/s1
InChIKeyLFNMHYAMCXXWNQ-CYBMUJFWSA-N
XLogP3.61
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.43
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[(2S)-1-methylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine
CID 124993584
N-(4-methyl-1,2,5-oxadiazol-3-yl)-2-[2-[2-(pyrimidin-2-ylamino)-1,3-thiazol-4-yl]piperidin-1-yl]acetamide
CID 175655896
N-[2-methyl-6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 95820390
2-(1-propan-2-ylpiperidin-2-yl)-1,3-thiazole
CID 67986575
2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine
CID 89274443
6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
CID 110253678
N-cyclohexyl-3-(1-propan-2-ylpiperidin-2-yl)pyridin-2-amine
CID 102540493
2-[2-[2-methyl-6-(pyrimidin-2-ylamino)pyrimidin-4-yl]pyrrolidin-1-yl]propane-1,3-diol
CID 110256879
1-[2-[2-(pyridin-2-ylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]propan-1-one
CID 110270541
3-methyl-2-(1-propan-2-ylpiperidin-2-yl)imidazo[4,5-b]pyridine
CID 117163034
N-methyl-2-[2-[2-(pyridin-2-ylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]acetamide
CID 175655316
2-methyl-N-pyrimidin-2-yl-6-[(2S)-1-pyrimidin-2-ylpiperidin-2-yl]pyrimidin-4-amine
CID 95842576

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine (CID 124976453) is 4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine is CC(C)N1CCCC[C@@H]1c1csc(Nc2ncccn2)n1.
What is the InChIKey of 4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine?
The InChIKey is LFNMHYAMCXXWNQ-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H21N5S/c1-11(2)20-9-4-3-6-13(20)12-10-21-15(18-12)19-14-16-7-5-8-17-14/h5,7-8,10-11,13H,3-4,6,9H2,1-2H3,(H,16,17,18,19)/t13-/m1/s1.
What are the key properties of 4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine?
4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine has a molecular weight of 303.43 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 124976453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).