6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione

C10H18N4O2 — CID 78277206

IUPAC6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione
SMILESCN1C(=O)NC(=O)C(N2CCCCC2)C1N
InChIInChI=1S/C10H18N4O2/c1-13-8(11)7(9(15)12-10(13)16)14-5-3-2-4-6-14/h7-8H,2-6,11H2,1H3,(H,12,15,16)
InChIKeyWHAYRUURWORRIQ-UHFFFAOYSA-N
MW226.28 g/mol
LogP-0.69
Rot. Bonds1

About 6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione

6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione (PubChem CID 78277206) has the molecular formula C10H18N4O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione.

Molecular Properties

Compound Name6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione
PubChem CID78277206
Molecular FormulaC10H18N4O2
Molecular Weight226.28 g/mol
Exact Mass226.14
IUPAC Name6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione
SMILESCN1C(=O)NC(=O)C(N2CCCCC2)C1N
InChIInChI=1S/C10H18N4O2/c1-13-8(11)7(9(15)12-10(13)16)14-5-3-2-4-6-14/h7-8H,2-6,11H2,1H3,(H,12,15,16)
InChIKeyWHAYRUURWORRIQ-UHFFFAOYSA-N
XLogP-0.69
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 5-0.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione?
The IUPAC name of 6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione (CID 78277206) is 6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione.
What is the SMILES notation for 6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione?
The canonical SMILES for 6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione is CN1C(=O)NC(=O)C(N2CCCCC2)C1N.
What is the InChIKey of 6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione?
The InChIKey is WHAYRUURWORRIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2/c1-13-8(11)7(9(15)12-10(13)16)14-5-3-2-4-6-14/h7-8H,2-6,11H2,1H3,(H,12,15,16).
What are the key properties of 6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione?
6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione has a molecular weight of 226.28 g/mol, XLogP of -0.69, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-methyl-5-piperidin-1-yl-1,3-diazinane-2,4-dione is sourced from PubChem (CID 78277206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).