3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol

C14H24N4O — CID 72898055

IUPAC3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol
SMILESCc1ncnc(N2CCCC(O)(CN(C)C)C2)c1C
InChIInChI=1S/C14H24N4O/c1-11-12(2)15-10-16-13(11)18-7-5-6-14(19,9-18)8-17(3)4/h10,19H,5-9H2,1-4H3
InChIKeyBMMDVSMWCYLUNT-UHFFFAOYSA-N
MW264.37 g/mol
LogP0.99
Rot. Bonds3

About 3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol

3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol (PubChem CID 72898055) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol.

Molecular Properties

Compound Name3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol
PubChem CID72898055
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol
SMILESCc1ncnc(N2CCCC(O)(CN(C)C)C2)c1C
InChIInChI=1S/C14H24N4O/c1-11-12(2)15-10-16-13(11)18-7-5-6-14(19,9-18)8-17(3)4/h10,19H,5-9H2,1-4H3
InChIKeyBMMDVSMWCYLUNT-UHFFFAOYSA-N
XLogP0.99
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1-{3-[(5,6-Dimethylpyrimidin-4-YL)amino]propyl}piperidin-2-YL)methanol
CID 72906961
2-[(2S)-4-(5,6-dimethylpyrimidin-4-yl)-1-(1-propan-2-ylpiperidin-4-yl)piperazin-2-yl]ethanol
CID 98771523
(3S,4S)-1-(5-fluoro-6-methylpyrimidin-4-yl)-3-methylpiperidin-4-ol
CID 118056446
3-Cyclopropyl-1-(5-fluoro-6-methylpyrimidin-4-yl)azetidin-3-ol
CID 102975982
1-(5-Fluoro-6-methylpyrimidin-4-yl)-4-methylpiperidin-4-ol
CID 103761635
1-[[(5-Fluoro-6-methylpyrimidin-4-yl)-methylamino]methyl]cyclopentan-1-ol
CID 103837873
1-(5-Fluoro-6-methylpyrimidin-4-yl)-3-methylpiperidin-3-ol
CID 103878215
1-(5-Fluoro-6-methylpyrimidin-4-yl)-4-methylpiperidin-3-ol
CID 103896207
1-(5-Fluoro-6-methylpyrimidin-4-yl)-3-methylpiperidin-4-ol
CID 104952904
(3S)-1-(5-fluoro-6-methylpyrimidin-4-yl)piperidin-3-ol
CID 107269396
1-[(5-Fluoro-6-methylpyrimidin-4-yl)amino]-2,4-dimethylpentan-2-ol
CID 108151462
1-(5-Fluoro-6-methylpyrimidin-4-yl)-3-propylazetidin-3-ol
CID 108152163

Frequently Asked Questions

What is the IUPAC name of 3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol?
The IUPAC name of 3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol (CID 72898055) is 3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol.
What is the SMILES notation for 3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol?
The canonical SMILES for 3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol is Cc1ncnc(N2CCCC(O)(CN(C)C)C2)c1C.
What is the InChIKey of 3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol?
The InChIKey is BMMDVSMWCYLUNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-11-12(2)15-10-16-13(11)18-7-5-6-14(19,9-18)8-17(3)4/h10,19H,5-9H2,1-4H3.
What are the key properties of 3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol?
3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol has a molecular weight of 264.37 g/mol, XLogP of 0.99, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(dimethylamino)methyl]-1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-ol is sourced from PubChem (CID 72898055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).