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

C12H22N6O — CID 114681501

IUPAC1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol
SMILESCC1CN(Cc2nc(N)nc(N(C)C)n2)CCC1O
InChIInChI=1S/C12H22N6O/c1-8-6-18(5-4-9(8)19)7-10-14-11(13)16-12(15-10)17(2)3/h8-9,19H,4-7H2,1-3H3,(H2,13,14,15,16)
InChIKeyVEFCNZVOQQWAOB-UHFFFAOYSA-N
MW266.35 g/mol
LogP-0.28
Rot. Bonds3

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

1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol (PubChem CID 114681501) has the molecular formula C12H22N6O and a molecular weight of 266.35 g/mol. Its IUPAC name is 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol
PubChem CID114681501
Molecular FormulaC12H22N6O
Molecular Weight266.35 g/mol
Exact Mass266.19
IUPAC Name1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol
SMILESCC1CN(Cc2nc(N)nc(N(C)C)n2)CCC1O
InChIInChI=1S/C12H22N6O/c1-8-6-18(5-4-9(8)19)7-10-14-11(13)16-12(15-10)17(2)3/h8-9,19H,4-7H2,1-3H3,(H2,13,14,15,16)
InChIKeyVEFCNZVOQQWAOB-UHFFFAOYSA-N
XLogP-0.28
TPSA91.40 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 ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol with MolForge

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Related Compounds

1-[1-[[4-Amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]piperidin-4-yl]ethanol
CID 56787472
1-[4-(4-Hydroxypiperidin-1-yl)-6-methyl-1,3,5-triazin-2-yl]piperidin-4-ol
CID 58012611
1-[1-[4-Amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]piperidin-4-ol
CID 18124363
1-[1-[4-Amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]piperidin-3-ol
CID 47129740
1-[(4,6-Diamino-1,3,5-triazin-2-yl)methyl]piperidin-3-ol
CID 60669690
[1-[(4,6-Diamino-1,3,5-triazin-2-yl)methyl]piperidin-3-yl]methanol
CID 60669835
1-[(4,6-Diamino-1,3,5-triazin-2-yl)methyl]piperidin-4-ol
CID 60670253
[1-[[4-Amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]piperidin-3-yl]methanol
CID 60702713
[1-[(4,6-Diamino-1,3,5-triazin-2-yl)methyl]piperidin-4-yl]methanol
CID 60968067
[1-[[4-Amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]piperidin-4-yl]methanol
CID 62021578
2-[1-[(4,6-Diamino-1,3,5-triazin-2-yl)methyl]piperidin-3-yl]ethanol
CID 62357340
2-[1-[[4-Amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]piperidin-3-yl]ethanol
CID 62357851

Frequently Asked Questions

What is the IUPAC name of 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol?
The IUPAC name of 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol (CID 114681501) is 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol?
The canonical SMILES for 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol is CC1CN(Cc2nc(N)nc(N(C)C)n2)CCC1O.
What is the InChIKey of 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol?
The InChIKey is VEFCNZVOQQWAOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N6O/c1-8-6-18(5-4-9(8)19)7-10-14-11(13)16-12(15-10)17(2)3/h8-9,19H,4-7H2,1-3H3,(H2,13,14,15,16).
What are the key properties of 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol?
1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol has a molecular weight of 266.35 g/mol, XLogP of -0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-3-methylpiperidin-4-ol is sourced from PubChem (CID 114681501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).