(4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea

C6H10N6O2 — CID 13296069

IUPAC(4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea
SMILESCCOc1nc(N)nc(NC(N)=O)n1
InChIInChI=1S/C6H10N6O2/c1-2-14-6-10-3(7)9-5(12-6)11-4(8)13/h2H2,1H3,(H5,7,8,9,10,11,12,13)
InChIKeyHXTBBPRUQJQDRL-UHFFFAOYSA-N
MW198.19 g/mol
LogP-0.66
Rot. Bonds3

About (4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea

(4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea (PubChem CID 13296069) has the molecular formula C6H10N6O2 and a molecular weight of 198.19 g/mol. Its IUPAC name is (4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea.

Molecular Properties

Compound Name(4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea
PubChem CID13296069
Molecular FormulaC6H10N6O2
Molecular Weight198.19 g/mol
Exact Mass198.09
IUPAC Name(4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea
SMILESCCOc1nc(N)nc(NC(N)=O)n1
InChIInChI=1S/C6H10N6O2/c1-2-14-6-10-3(7)9-5(12-6)11-4(8)13/h2H2,1H3,(H5,7,8,9,10,11,12,13)
InChIKeyHXTBBPRUQJQDRL-UHFFFAOYSA-N
XLogP-0.66
TPSA129.04 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.19
LogP ≤ 5-0.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea?
The IUPAC name of (4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea (CID 13296069) is (4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea.
What is the SMILES notation for (4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea?
The canonical SMILES for (4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea is CCOc1nc(N)nc(NC(N)=O)n1.
What is the InChIKey of (4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea?
The InChIKey is HXTBBPRUQJQDRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N6O2/c1-2-14-6-10-3(7)9-5(12-6)11-4(8)13/h2H2,1H3,(H5,7,8,9,10,11,12,13).
What are the key properties of (4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea?
(4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea has a molecular weight of 198.19 g/mol, XLogP of -0.66, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-6-ethoxy-1,3,5-triazin-2-yl)urea is sourced from PubChem (CID 13296069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).