6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione

C7H14N4O2 — CID 72738027

IUPAC6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione
SMILESCCNC1C(=O)NC(=O)N(C)C1N
InChIInChI=1S/C7H14N4O2/c1-3-9-4-5(8)11(2)7(13)10-6(4)12/h4-5,9H,3,8H2,1-2H3,(H,10,12,13)
InChIKeyCKQDIHXXMVTCLG-UHFFFAOYSA-N
MW186.21 g/mol
LogP-1.57
Rot. Bonds2

About 6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione

6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione (PubChem CID 72738027) has the molecular formula C7H14N4O2 and a molecular weight of 186.21 g/mol. Its IUPAC name is 6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione.

Molecular Properties

Compound Name6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione
PubChem CID72738027
Molecular FormulaC7H14N4O2
Molecular Weight186.21 g/mol
Exact Mass186.11
IUPAC Name6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione
SMILESCCNC1C(=O)NC(=O)N(C)C1N
InChIInChI=1S/C7H14N4O2/c1-3-9-4-5(8)11(2)7(13)10-6(4)12/h4-5,9H,3,8H2,1-2H3,(H,10,12,13)
InChIKeyCKQDIHXXMVTCLG-UHFFFAOYSA-N
XLogP-1.57
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-1.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione?
The IUPAC name of 6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione (CID 72738027) is 6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione.
What is the SMILES notation for 6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione?
The canonical SMILES for 6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione is CCNC1C(=O)NC(=O)N(C)C1N.
What is the InChIKey of 6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione?
The InChIKey is CKQDIHXXMVTCLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4O2/c1-3-9-4-5(8)11(2)7(13)10-6(4)12/h4-5,9H,3,8H2,1-2H3,(H,10,12,13).
What are the key properties of 6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione?
6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione has a molecular weight of 186.21 g/mol, XLogP of -1.57, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-(ethylamino)-1-methyl-1,3-diazinane-2,4-dione is sourced from PubChem (CID 72738027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).