(R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol

C17H22N4O — CID 39809044

IUPAC(R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol
SMILESCc1cc(C)nc(N2CCC([C@@H](O)c3ccccn3)CC2)n1
InChIInChI=1S/C17H22N4O/c1-12-11-13(2)20-17(19-12)21-9-6-14(7-10-21)16(22)15-5-3-4-8-18-15/h3-5,8,11,14,16,22H,6-7,9-10H2,1-2H3/t16-/m1/s1
InChIKeyTVWQOQABWRROBJ-MRXNPFEDSA-N
MW298.39 g/mol
LogP2.44
Rot. Bonds3

About (R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol

(R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol (PubChem CID 39809044) has the molecular formula C17H22N4O and a molecular weight of 298.39 g/mol. Its IUPAC name is (R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol.

Molecular Properties

Compound Name(R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol
PubChem CID39809044
Molecular FormulaC17H22N4O
Molecular Weight298.39 g/mol
Exact Mass298.18
IUPAC Name(R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol
SMILESCc1cc(C)nc(N2CCC([C@@H](O)c3ccccn3)CC2)n1
InChIInChI=1S/C17H22N4O/c1-12-11-13(2)20-17(19-12)21-9-6-14(7-10-21)16(22)15-5-3-4-8-18-15/h3-5,8,11,14,16,22H,6-7,9-10H2,1-2H3/t16-/m1/s1
InChIKeyTVWQOQABWRROBJ-MRXNPFEDSA-N
XLogP2.44
TPSA62.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

pyridin-2-yl-[1-(4-pyridin-2-ylpyrimidin-2-yl)piperidin-4-yl]methanol
CID 72918650
[1-(6-methyl-[1,2,4]triazolo[4,3-b]pyridazin-8-yl)piperidin-4-yl]-pyridin-2-ylmethanol
CID 176502793
pyridin-2-yl-[1-(4,7,8-trimethylquinolin-2-yl)piperidin-4-yl]methanol
CID 134698380
2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 92634141
(R)-[1-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 99933667
1-[4-[hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-2-(3-methyl-1,2-oxazol-5-yl)ethanone
CID 91839918
2-[4-(1-chloroethyl)piperidin-1-yl]-4,6-dimethylpyrimidine
CID 106838422
(2-amino-4-methylpyrimidin-5-yl)-[4-[(R)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]methanone
CID 99947231
(R)-[1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 124751770
(R)-pyridin-2-yl-[1-(6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-yl)piperidin-4-yl]methanol
CID 95894050
[4-[hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-(5-propan-2-yl-1,2-oxazol-3-yl)methanone
CID 70704336
[1-[(3-ethoxyphenyl)methyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 53193333

Frequently Asked Questions

What is the IUPAC name of (R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol?
The IUPAC name of (R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol (CID 39809044) is (R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol.
What is the SMILES notation for (R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol?
The canonical SMILES for (R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol is Cc1cc(C)nc(N2CCC([C@@H](O)c3ccccn3)CC2)n1.
What is the InChIKey of (R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol?
The InChIKey is TVWQOQABWRROBJ-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H22N4O/c1-12-11-13(2)20-17(19-12)21-9-6-14(7-10-21)16(22)15-5-3-4-8-18-15/h3-5,8,11,14,16,22H,6-7,9-10H2,1-2H3/t16-/m1/s1.
What are the key properties of (R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol?
(R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol has a molecular weight of 298.39 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-pyridin-2-ylmethanol is sourced from PubChem (CID 39809044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).