N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine

C15H20N4S — CID 124966086

IUPACN-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine
SMILESCNc1nccc([C@H]2CCCCN2Cc2cccs2)n1
InChIInChI=1S/C15H20N4S/c1-16-15-17-8-7-13(18-15)14-6-2-3-9-19(14)11-12-5-4-10-20-12/h4-5,7-8,10,14H,2-3,6,9,11H2,1H3,(H,16,17,18)/t14-/m1/s1
InChIKeyIJLJIMQUBVJEQF-CQSZACIVSA-N
MW288.42 g/mol
LogP3.31
Rot. Bonds4

About N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine

N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine (PubChem CID 124966086) has the molecular formula C15H20N4S and a molecular weight of 288.42 g/mol. Its IUPAC name is N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine.

Molecular Properties

Compound NameN-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine
PubChem CID124966086
Molecular FormulaC15H20N4S
Molecular Weight288.42 g/mol
Exact Mass288.14
IUPAC NameN-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine
SMILESCNc1nccc([C@H]2CCCCN2Cc2cccs2)n1
InChIInChI=1S/C15H20N4S/c1-16-15-17-8-7-13(18-15)14-6-2-3-9-19(14)11-12-5-4-10-20-12/h4-5,7-8,10,14H,2-3,6,9,11H2,1H3,(H,16,17,18)/t14-/m1/s1
InChIKeyIJLJIMQUBVJEQF-CQSZACIVSA-N
XLogP3.31
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.42
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-4-[1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidine
CID 127244795
N-methyl-4-[1-(pyridin-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine
CID 127244807
N-methyl-4-[(2R)-1-[[2-(methylamino)pyrimidin-5-yl]methyl]piperidin-2-yl]pyrimidin-2-amine
CID 124967538
4-[(2S)-1-[(4-methoxyphenyl)methyl]piperidin-2-yl]-N-methylpyrimidin-2-amine
CID 124951811
N-methyl-4-[(2R)-1-[(1-propan-2-ylimidazol-2-yl)methyl]piperidin-2-yl]pyrimidin-2-amine
CID 125015958
N-methyl-6-[1-(thiophen-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine
CID 132776032
N-methyl-4-[1-[(2-propylpyrimidin-5-yl)methyl]piperidin-2-yl]pyrimidin-2-amine
CID 127244826
2-(2-methylimidazol-1-yl)-6-[(2S)-1-(thiophen-2-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95815698
4-[(2R)-1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-2-yl]-N-methylpyrimidin-2-amine
CID 124965793
4-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-2-yl]-N-methylpyrimidin-2-amine
CID 127244806
N-[4-[1-(pyridin-4-ylmethyl)piperidin-2-yl]pyrimidin-2-yl]-1,3-thiazol-2-amine
CID 110267234
N-[4-[(2S)-1-(pyridin-4-ylmethyl)piperidin-2-yl]pyrimidin-2-yl]-1,3-thiazol-2-amine
CID 95837562

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine?
The IUPAC name of N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine (CID 124966086) is N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine.
What is the SMILES notation for N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine?
The canonical SMILES for N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine is CNc1nccc([C@H]2CCCCN2Cc2cccs2)n1.
What is the InChIKey of N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine?
The InChIKey is IJLJIMQUBVJEQF-CQSZACIVSA-N. The full InChI is InChI=1S/C15H20N4S/c1-16-15-17-8-7-13(18-15)14-6-2-3-9-19(14)11-12-5-4-10-20-12/h4-5,7-8,10,14H,2-3,6,9,11H2,1H3,(H,16,17,18)/t14-/m1/s1.
What are the key properties of N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine?
N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine has a molecular weight of 288.42 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(2R)-1-(thiophen-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine is sourced from PubChem (CID 124966086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).