1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol

C14H25N5O — CID 133446566

IUPAC1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol
SMILESCC(C)c1nc(N(C)C)nc(N2CCC(C)C(O)C2)n1
InChIInChI=1S/C14H25N5O/c1-9(2)12-15-13(18(4)5)17-14(16-12)19-7-6-10(3)11(20)8-19/h9-11,20H,6-8H2,1-5H3
InChIKeyIDMLCGFTKQUFPJ-UHFFFAOYSA-N
MW279.39 g/mol
LogP1.27
Rot. Bonds3

About 1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol

1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol (PubChem CID 133446566) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is 1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol.

Molecular Properties

Compound Name1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol
PubChem CID133446566
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC Name1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol
SMILESCC(C)c1nc(N(C)C)nc(N2CCC(C)C(O)C2)n1
InChIInChI=1S/C14H25N5O/c1-9(2)12-15-13(18(4)5)17-14(16-12)19-7-6-10(3)11(20)8-19/h9-11,20H,6-8H2,1-5H3
InChIKeyIDMLCGFTKQUFPJ-UHFFFAOYSA-N
XLogP1.27
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol?
The IUPAC name of 1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol (CID 133446566) is 1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol.
What is the SMILES notation for 1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol?
The canonical SMILES for 1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol is CC(C)c1nc(N(C)C)nc(N2CCC(C)C(O)C2)n1.
What is the InChIKey of 1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol?
The InChIKey is IDMLCGFTKQUFPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-9(2)12-15-13(18(4)5)17-14(16-12)19-7-6-10(3)11(20)8-19/h9-11,20H,6-8H2,1-5H3.
What are the key properties of 1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol?
1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol has a molecular weight of 279.39 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(dimethylamino)-6-propan-2-yl-1,3,5-triazin-2-yl]-4-methylpiperidin-3-ol is sourced from PubChem (CID 133446566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).