N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide

C10H15IN4O2 — CID 10736566

IUPACN'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide
SMILESC/C(=N\c1c(I)c(=O)n(C)c(=O)n1C)N(C)C
InChIInChI=1S/C10H15IN4O2/c1-6(13(2)3)12-8-7(11)9(16)15(5)10(17)14(8)4/h1-5H3/b12-6+
InChIKeyHAYVCCYELZNLFV-WUXMJOGZSA-N
MW350.16 g/mol
LogP0.30
Rot. Bonds1

About N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide

N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide (PubChem CID 10736566) has the molecular formula C10H15IN4O2 and a molecular weight of 350.16 g/mol. Its IUPAC name is N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide.

Molecular Properties

Compound NameN'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide
PubChem CID10736566
Molecular FormulaC10H15IN4O2
Molecular Weight350.16 g/mol
Exact Mass350.02
IUPAC NameN'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide
SMILESC/C(=N\c1c(I)c(=O)n(C)c(=O)n1C)N(C)C
InChIInChI=1S/C10H15IN4O2/c1-6(13(2)3)12-8-7(11)9(16)15(5)10(17)14(8)4/h1-5H3/b12-6+
InChIKeyHAYVCCYELZNLFV-WUXMJOGZSA-N
XLogP0.30
TPSA59.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.16
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide?
The IUPAC name of N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide (CID 10736566) is N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide.
What is the SMILES notation for N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide?
The canonical SMILES for N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide is C/C(=N\c1c(I)c(=O)n(C)c(=O)n1C)N(C)C.
What is the InChIKey of N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide?
The InChIKey is HAYVCCYELZNLFV-WUXMJOGZSA-N. The full InChI is InChI=1S/C10H15IN4O2/c1-6(13(2)3)12-8-7(11)9(16)15(5)10(17)14(8)4/h1-5H3/b12-6+.
What are the key properties of N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide?
N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide has a molecular weight of 350.16 g/mol, XLogP of 0.30, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5-iodo-1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N,N-dimethylethanimidamide is sourced from PubChem (CID 10736566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).