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

C10H16N4O2 — CID 43410478

IUPAC6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione
SMILESCn1nc(NC2CCCC2)c(=O)n(C)c1=O
InChIInChI=1S/C10H16N4O2/c1-13-9(15)8(12-14(2)10(13)16)11-7-5-3-4-6-7/h7H,3-6H2,1-2H3,(H,11,12)
InChIKeyRUUNSVUKKCOMJF-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.17
Rot. Bonds2

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

6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione (PubChem CID 43410478) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione.

Molecular Properties

Compound Name6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione
PubChem CID43410478
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione
SMILESCn1nc(NC2CCCC2)c(=O)n(C)c1=O
InChIInChI=1S/C10H16N4O2/c1-13-9(15)8(12-14(2)10(13)16)11-7-5-3-4-6-7/h7H,3-6H2,1-2H3,(H,11,12)
InChIKeyRUUNSVUKKCOMJF-UHFFFAOYSA-N
XLogP-0.17
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The IUPAC name of 6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione (CID 43410478) is 6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione.
What is the SMILES notation for 6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The canonical SMILES for 6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione is Cn1nc(NC2CCCC2)c(=O)n(C)c1=O.
What is the InChIKey of 6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The InChIKey is RUUNSVUKKCOMJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-13-9(15)8(12-14(2)10(13)16)11-7-5-3-4-6-7/h7H,3-6H2,1-2H3,(H,11,12).
What are the key properties of 6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione?
6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione has a molecular weight of 224.26 g/mol, XLogP of -0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopentylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione is sourced from PubChem (CID 43410478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).