(1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol

C17H25N5O — CID 162635184

IUPAC(1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol
SMILESCc1nc(N2CCC(C(O)c3nccn3C)CC2)nc(C)c1C
InChIInChI=1S/C17H25N5O/c1-11-12(2)19-17(20-13(11)3)22-8-5-14(6-9-22)15(23)16-18-7-10-21(16)4/h7,10,14-15,23H,5-6,8-9H2,1-4H3
InChIKeyOEMNWOUBKRCYEY-UHFFFAOYSA-N
MW315.42 g/mol
LogP2.09
Rot. Bonds3

About (1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol

(1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol (PubChem CID 162635184) has the molecular formula C17H25N5O and a molecular weight of 315.42 g/mol. Its IUPAC name is (1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name(1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol
PubChem CID162635184
Molecular FormulaC17H25N5O
Molecular Weight315.42 g/mol
Exact Mass315.21
IUPAC Name(1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol
SMILESCc1nc(N2CCC(C(O)c3nccn3C)CC2)nc(C)c1C
InChIInChI=1S/C17H25N5O/c1-11-12(2)19-17(20-13(11)3)22-8-5-14(6-9-22)15(23)16-18-7-10-21(16)4/h7,10,14-15,23H,5-6,8-9H2,1-4H3
InChIKeyOEMNWOUBKRCYEY-UHFFFAOYSA-N
XLogP2.09
TPSA67.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol?
The IUPAC name of (1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol (CID 162635184) is (1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol.
What is the SMILES notation for (1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol?
The canonical SMILES for (1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol is Cc1nc(N2CCC(C(O)c3nccn3C)CC2)nc(C)c1C.
What is the InChIKey of (1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol?
The InChIKey is OEMNWOUBKRCYEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N5O/c1-11-12(2)19-17(20-13(11)3)22-8-5-14(6-9-22)15(23)16-18-7-10-21(16)4/h7,10,14-15,23H,5-6,8-9H2,1-4H3.
What are the key properties of (1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol?
(1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol has a molecular weight of 315.42 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylimidazol-2-yl)-[1-(4,5,6-trimethylpyrimidin-2-yl)piperidin-4-yl]methanol is sourced from PubChem (CID 162635184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).