4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine

C16H21N5 — CID 124959792

IUPAC4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine
SMILESCc1cncc([C@H]2CCCN(c3nc(C)cc(C)n3)C2)n1
InChIInChI=1S/C16H21N5/c1-11-7-12(2)20-16(19-11)21-6-4-5-14(10-21)15-9-17-8-13(3)18-15/h7-9,14H,4-6,10H2,1-3H3/t14-/m0/s1
InChIKeyGPTPENHYXGCCSS-AWEZNQCLSA-N
MW283.38 g/mol
LogP2.58
Rot. Bonds2

About 4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine

4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine (PubChem CID 124959792) has the molecular formula C16H21N5 and a molecular weight of 283.38 g/mol. Its IUPAC name is 4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine.

Molecular Properties

Compound Name4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine
PubChem CID124959792
Molecular FormulaC16H21N5
Molecular Weight283.38 g/mol
Exact Mass283.18
IUPAC Name4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine
SMILESCc1cncc([C@H]2CCCN(c3nc(C)cc(C)n3)C2)n1
InChIInChI=1S/C16H21N5/c1-11-7-12(2)20-16(19-11)21-6-4-5-14(10-21)15-9-17-8-13(3)18-15/h7-9,14H,4-6,10H2,1-3H3/t14-/m0/s1
InChIKeyGPTPENHYXGCCSS-AWEZNQCLSA-N
XLogP2.58
TPSA54.80 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-6-[(3S)-1-phenylpiperidin-3-yl]pyrazine
CID 125020783
4,6-dimethyl-2-[3-(2-methylpyrimidin-4-yl)piperidin-1-yl]pyrimidine
CID 110257012
2-(3-bromopiperidin-1-yl)-4,6-dimethylpyrimidine
CID 80673034
2-(3-chloropiperidin-1-yl)-4,6-dimethylpyrimidine
CID 63391936
2-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]-4,6-dimethylpyrimidine
CID 95829311
5-methyl-3-[[(3R)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]methyl]-1,2-oxazole
CID 125012518
2-[(3R)-3-(3-imidazol-1-ylpyrazin-2-yl)piperidin-1-yl]-4,6-dimethylpyrimidine
CID 95829339
N,N-dimethyl-3-(6-methylpyrazin-2-yl)piperidine-1-sulfonamide
CID 110257001
3-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-3-yl]-2H-pyrazolo[3,4-b]pyrazine
CID 110259066
2-methyl-6-[1-[(6-methyl-3-pyridinyl)methyl]piperidin-3-yl]pyrazine
CID 110259175
2-[3-(6-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine
CID 110254065
2-methyl-4-[[3-(6-methylpyrazin-2-yl)piperidin-1-yl]methyl]pyrimidine
CID 110096341

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine?
The IUPAC name of 4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine (CID 124959792) is 4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine.
What is the SMILES notation for 4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine?
The canonical SMILES for 4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine is Cc1cncc([C@H]2CCCN(c3nc(C)cc(C)n3)C2)n1.
What is the InChIKey of 4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine?
The InChIKey is GPTPENHYXGCCSS-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H21N5/c1-11-7-12(2)20-16(19-11)21-6-4-5-14(10-21)15-9-17-8-13(3)18-15/h7-9,14H,4-6,10H2,1-3H3/t14-/m0/s1.
What are the key properties of 4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine?
4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine has a molecular weight of 283.38 g/mol, XLogP of 2.58, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]pyrimidine is sourced from PubChem (CID 124959792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).