4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine

C16H20N4 — CID 95845313

IUPAC4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine
SMILESCc1ccc([C@@H]2CCCN(c3cc(C)ncn3)C2)nc1
InChIInChI=1S/C16H20N4/c1-12-5-6-15(17-9-12)14-4-3-7-20(10-14)16-8-13(2)18-11-19-16/h5-6,8-9,11,14H,3-4,7,10H2,1-2H3/t14-/m1/s1
InChIKeyKSOLTOZPNWNNHV-CQSZACIVSA-N
MW268.36 g/mol
LogP2.87
Rot. Bonds2

About 4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine

4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine (PubChem CID 95845313) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine.

Molecular Properties

Compound Name4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine
PubChem CID95845313
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine
SMILESCc1ccc([C@@H]2CCCN(c3cc(C)ncn3)C2)nc1
InChIInChI=1S/C16H20N4/c1-12-5-6-15(17-9-12)14-4-3-7-20(10-14)16-8-13(2)18-11-19-16/h5-6,8-9,11,14H,3-4,7,10H2,1-2H3/t14-/m1/s1
InChIKeyKSOLTOZPNWNNHV-CQSZACIVSA-N
XLogP2.87
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine
CID 62545669
5-methyl-2-(1-sulfanylpiperidin-3-yl)pyridine
CID 89100449
2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine
CID 110253590
N-methyl-4-[(3S)-1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyridin-2-amine
CID 125025536
3-(5-methyl-2-pyridinyl)piperidine-1-carbaldehyde
CID 140789844
N-[4-[(3S)-1-(6-methylpyrimidin-4-yl)piperidin-3-yl]-1,3-thiazol-2-yl]acetamide
CID 95829191
4-methyl-6-[(3S)-3-(4-methyl-1,2,4-triazol-3-yl)pyrrolidin-1-yl]pyrimidine
CID 95842094
2-[3-(5-methyl-2-pyridinyl)piperidin-1-yl]ethanol
CID 73440472
1-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]ethanone
CID 63846340
4-methyl-6-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]pyrimidine
CID 95841714
2-cyclohexyl-5-methylpyridine
CID 83382376
N,N,4-trimethyl-2-[(3S)-1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrimidine-5-carboxamide
CID 95838085

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine?
The IUPAC name of 4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine (CID 95845313) is 4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine.
What is the SMILES notation for 4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine?
The canonical SMILES for 4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine is Cc1ccc([C@@H]2CCCN(c3cc(C)ncn3)C2)nc1.
What is the InChIKey of 4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine?
The InChIKey is KSOLTOZPNWNNHV-CQSZACIVSA-N. The full InChI is InChI=1S/C16H20N4/c1-12-5-6-15(17-9-12)14-4-3-7-20(10-14)16-8-13(2)18-11-19-16/h5-6,8-9,11,14H,3-4,7,10H2,1-2H3/t14-/m1/s1.
What are the key properties of 4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine?
4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine has a molecular weight of 268.36 g/mol, XLogP of 2.87, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine is sourced from PubChem (CID 95845313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).