2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione

C10H17N5O2 — CID 43646890

IUPAC2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione
SMILESCn1nc(NC2CCNCC2)c(=O)n(C)c1=O
InChIInChI=1S/C10H17N5O2/c1-14-9(16)8(13-15(2)10(14)17)12-7-3-5-11-6-4-7/h7,11H,3-6H2,1-2H3,(H,12,13)
InChIKeyIMIMDIPNRDVSKW-UHFFFAOYSA-N
MW239.28 g/mol
LogP-1.36
Rot. Bonds2

About 2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione

2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione (PubChem CID 43646890) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is 2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione.

Molecular Properties

Compound Name2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione
PubChem CID43646890
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC Name2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione
SMILESCn1nc(NC2CCNCC2)c(=O)n(C)c1=O
InChIInChI=1S/C10H17N5O2/c1-14-9(16)8(13-15(2)10(14)17)12-7-3-5-11-6-4-7/h7,11H,3-6H2,1-2H3,(H,12,13)
InChIKeyIMIMDIPNRDVSKW-UHFFFAOYSA-N
XLogP-1.36
TPSA80.95 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-1.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione with MolForge

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Launch Full Analysis

Related Compounds

6-(3-Oxo-3-piperidin-1-yl-propylamino)-2H-[1,2,4]triazine-3,5-dione
CID 647816
4-Methyl-6-piperazin-1-yl-2-(4,4,4-trifluorobutyl)-1,2,4-triazine-3,5-dione
CID 124152031
6-[[(3R,5R)-5-fluoro-1-methylpiperidin-3-yl]amino]-4-methyl-2H-1,2,4-triazine-3,5-dione
CID 177934184
N-methyl-2-(4-(4-methyl-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-1,2,4-triazol-1-yl)piperidin-1-yl)acetamide
CID 122268832
2-(4-(4-methyl-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-1,2,4-triazol-1-yl)piperidin-1-yl)-N-propylacetamide
CID 122268833
N-isopropyl-2-(4-(4-methyl-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-1,2,4-triazol-1-yl)piperidin-1-yl)acetamide
CID 122268835
N-ethyl-2-(4-(4-methyl-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-1,2,4-triazol-1-yl)piperidin-1-yl)acetamide
CID 122268843
Sdccgsbi-0661557.P001
CID 4783663
2,4-dimethyl-6-(3-oxo-piperazin-1-yl)-2H-[1,2,4]triazine-3,5-dione
CID 16352503
2,4-dimethyl-6-(piperazin-1-yl)-1,2,4-triazine-3,5(2H,4H)-dione
CID 33781065
6-[2-(Diethylamino)ethylamino]-2,4-di(propan-2-yl)-1,2,4-triazine-3,5-dione
CID 52167907
6-[2-(Diethylamino)ethylamino]-2,4-dipropyl-1,2,4-triazine-3,5-dione
CID 52168158

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione?
The IUPAC name of 2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione (CID 43646890) is 2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione.
What is the SMILES notation for 2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione?
The canonical SMILES for 2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione is Cn1nc(NC2CCNCC2)c(=O)n(C)c1=O.
What is the InChIKey of 2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione?
The InChIKey is IMIMDIPNRDVSKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c1-14-9(16)8(13-15(2)10(14)17)12-7-3-5-11-6-4-7/h7,11H,3-6H2,1-2H3,(H,12,13).
What are the key properties of 2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione?
2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione has a molecular weight of 239.28 g/mol, XLogP of -1.36, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-(piperidin-4-ylamino)-1,2,4-triazine-3,5-dione is sourced from PubChem (CID 43646890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).