2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide

C17H22N6O — CID 95843433

IUPAC2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide
SMILESCc1nc(Nc2ccccn2)cc([C@H]2CCCCN2CC(N)=O)n1
InChIInChI=1S/C17H22N6O/c1-12-20-13(14-6-3-5-9-23(14)11-15(18)24)10-17(21-12)22-16-7-2-4-8-19-16/h2,4,7-8,10,14H,3,5-6,9,11H2,1H3,(H2,18,24)(H,19,20,21,22)/t14-/m1/s1
InChIKeyUTAJVZIIEJQJFY-CQSZACIVSA-N
MW326.40 g/mol
LogP1.94
Rot. Bonds5

About 2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide

2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide (PubChem CID 95843433) has the molecular formula C17H22N6O and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide
PubChem CID95843433
Molecular FormulaC17H22N6O
Molecular Weight326.40 g/mol
Exact Mass326.19
IUPAC Name2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide
SMILESCc1nc(Nc2ccccn2)cc([C@H]2CCCCN2CC(N)=O)n1
InChIInChI=1S/C17H22N6O/c1-12-20-13(14-6-3-5-9-23(14)11-15(18)24)10-17(21-12)22-16-7-2-4-8-19-16/h2,4,7-8,10,14H,3,5-6,9,11H2,1H3,(H2,18,24)(H,19,20,21,22)/t14-/m1/s1
InChIKeyUTAJVZIIEJQJFY-CQSZACIVSA-N
XLogP1.94
TPSA97.03 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[2-[2-(pyridin-2-ylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]acetamide
CID 110270492
2-methyl-6-[1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]-N-pyridin-2-ylpyrimidin-4-amine
CID 110095461
2-methyl-6-[(2R)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]-N-pyridin-2-ylpyrimidin-4-amine
CID 124998938
2-[(2S)-2-[2-(pyridin-2-ylamino)pyrimidin-4-yl]pyrrolidin-1-yl]acetamide
CID 95842902
6-[(2S)-1-(1H-imidazol-5-ylmethyl)piperidin-2-yl]-2-methyl-N-pyridin-2-ylpyrimidin-4-amine
CID 124979708
2-methyl-6-[(2R)-1-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-2-yl]-N-pyridin-2-ylpyrimidin-4-amine
CID 125016121
2-[2-[4-methyl-6-[(6-methyl-2-pyridinyl)amino]pyrimidin-2-yl]piperidin-1-yl]acetamide
CID 110270011
2-[2-[6-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-2-methylpyrimidin-4-yl]pyrrolidin-1-yl]acetamide
CID 110255924
2-cyclopentyl-1-[4-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperazin-1-yl]ethanone
CID 122349902
2-methyl-6-[(2S)-piperidin-2-yl]-N-pyridin-2-ylpyrimidin-4-amine
CID 124953762
N-methyl-2-[2-[2-(pyridin-2-ylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]acetamide
CID 175655316
2-methyl-6-[(2R)-1-(oxan-4-ylmethyl)piperidin-2-yl]-N-pyrimidin-2-ylpyrimidin-4-amine
CID 124997630

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide?
The IUPAC name of 2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide (CID 95843433) is 2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide is Cc1nc(Nc2ccccn2)cc([C@H]2CCCCN2CC(N)=O)n1.
What is the InChIKey of 2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide?
The InChIKey is UTAJVZIIEJQJFY-CQSZACIVSA-N. The full InChI is InChI=1S/C17H22N6O/c1-12-20-13(14-6-3-5-9-23(14)11-15(18)24)10-17(21-12)22-16-7-2-4-8-19-16/h2,4,7-8,10,14H,3,5-6,9,11H2,1H3,(H2,18,24)(H,19,20,21,22)/t14-/m1/s1.
What are the key properties of 2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide?
2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide has a molecular weight of 326.40 g/mol, XLogP of 1.94, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]piperidin-1-yl]acetamide is sourced from PubChem (CID 95843433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).