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

C12H22N6O — CID 114684030

IUPAC1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol
SMILESCNc1nc(N(C)C)nc(N2CCC(O)C(C)C2)n1
InChIInChI=1S/C12H22N6O/c1-8-7-18(6-5-9(8)19)12-15-10(13-2)14-11(16-12)17(3)4/h8-9,19H,5-7H2,1-4H3,(H,13,14,15,16)
InChIKeyPVMKWUSILZQMBM-UHFFFAOYSA-N
MW266.35 g/mol
LogP0.19
Rot. Bonds3

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

1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol (PubChem CID 114684030) has the molecular formula C12H22N6O and a molecular weight of 266.35 g/mol. Its IUPAC name is 1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol
PubChem CID114684030
Molecular FormulaC12H22N6O
Molecular Weight266.35 g/mol
Exact Mass266.19
IUPAC Name1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol
SMILESCNc1nc(N(C)C)nc(N2CCC(O)C(C)C2)n1
InChIInChI=1S/C12H22N6O/c1-8-7-18(6-5-9(8)19)12-15-10(13-2)14-11(16-12)17(3)4/h8-9,19H,5-7H2,1-4H3,(H,13,14,15,16)
InChIKeyPVMKWUSILZQMBM-UHFFFAOYSA-N
XLogP0.19
TPSA77.41 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine
CID 80835288
2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80764986
6-(2,6-dimethylmorpholin-4-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80764948
1-(4,6-dichloro-1,3,5-triazin-2-yl)-3-methylpiperidin-4-ol
CID 114679663
1-[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]piperidin-3-ol
CID 80906673
[1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpyrrolidin-2-yl]methanol
CID 102789968
7-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one
CID 80836471
6-(3,4-dihydro-1H-isoquinolin-2-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80751354
4-hydrazinyl-N,N-dimethyl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-1,3,5-triazin-2-amine
CID 80905094
1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-4-methylazepan-4-ol
CID 107409153
6-(2,4-dimethylpiperidin-1-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80826737
1-[5-chloro-2-(methylamino)pyrimidin-4-yl]-3-methylpiperidin-4-ol
CID 114684020

Frequently Asked Questions

What is the IUPAC name of 1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol?
The IUPAC name of 1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol (CID 114684030) is 1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol?
The canonical SMILES for 1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol is CNc1nc(N(C)C)nc(N2CCC(O)C(C)C2)n1.
What is the InChIKey of 1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol?
The InChIKey is PVMKWUSILZQMBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N6O/c1-8-7-18(6-5-9(8)19)12-15-10(13-2)14-11(16-12)17(3)4/h8-9,19H,5-7H2,1-4H3,(H,13,14,15,16).
What are the key properties of 1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol?
1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol has a molecular weight of 266.35 g/mol, XLogP of 0.19, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol is sourced from PubChem (CID 114684030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).