N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine

C10H18N4O2 — CID 22372062

IUPACN'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine
SMILESCNCCN(C)c1ncnc(OC)c1OC
InChIInChI=1S/C10H18N4O2/c1-11-5-6-14(2)9-8(15-3)10(16-4)13-7-12-9/h7,11H,5-6H2,1-4H3
InChIKeyJHYIXVNFGOSQOP-UHFFFAOYSA-N
MW226.28 g/mol
LogP0.15
Rot. Bonds6

About N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine

N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine (PubChem CID 22372062) has the molecular formula C10H18N4O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine
PubChem CID22372062
Molecular FormulaC10H18N4O2
Molecular Weight226.28 g/mol
Exact Mass226.14
IUPAC NameN'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine
SMILESCNCCN(C)c1ncnc(OC)c1OC
InChIInChI=1S/C10H18N4O2/c1-11-5-6-14(2)9-8(15-3)10(16-4)13-7-12-9/h7,11H,5-6H2,1-4H3
InChIKeyJHYIXVNFGOSQOP-UHFFFAOYSA-N
XLogP0.15
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine?
The IUPAC name of N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine (CID 22372062) is N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine?
The canonical SMILES for N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine is CNCCN(C)c1ncnc(OC)c1OC.
What is the InChIKey of N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine?
The InChIKey is JHYIXVNFGOSQOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2/c1-11-5-6-14(2)9-8(15-3)10(16-4)13-7-12-9/h7,11H,5-6H2,1-4H3.
What are the key properties of N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine?
N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine has a molecular weight of 226.28 g/mol, XLogP of 0.15, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5,6-dimethoxypyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 22372062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).