N,3-dimethylpyrimidin-4-imine;ethane

C8H15N3 — CID 143152236

IUPACN,3-dimethylpyrimidin-4-imine;ethane
SMILESC/N=c1\ccncn1C.CC
InChIInChI=1S/C6H9N3.C2H6/c1-7-6-3-4-8-5-9(6)2;1-2/h3-5H,1-2H3;1-2H3/b7-6+;
InChIKeyYSKLYEOSMVJZBP-UHDJGPCESA-N
MW153.23 g/mol
LogP0.98
Rot. Bonds

About N,3-dimethylpyrimidin-4-imine;ethane

N,3-dimethylpyrimidin-4-imine;ethane (PubChem CID 143152236) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is N,3-dimethylpyrimidin-4-imine;ethane.

Molecular Properties

Compound NameN,3-dimethylpyrimidin-4-imine;ethane
PubChem CID143152236
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC NameN,3-dimethylpyrimidin-4-imine;ethane
SMILESC/N=c1\ccncn1C.CC
InChIInChI=1S/C6H9N3.C2H6/c1-7-6-3-4-8-5-9(6)2;1-2/h3-5H,1-2H3;1-2H3/b7-6+;
InChIKeyYSKLYEOSMVJZBP-UHDJGPCESA-N
XLogP0.98
TPSA30.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethylpyrimidin-4-imine;ethane?
The IUPAC name of N,3-dimethylpyrimidin-4-imine;ethane (CID 143152236) is N,3-dimethylpyrimidin-4-imine;ethane.
What is the SMILES notation for N,3-dimethylpyrimidin-4-imine;ethane?
The canonical SMILES for N,3-dimethylpyrimidin-4-imine;ethane is C/N=c1\ccncn1C.CC.
What is the InChIKey of N,3-dimethylpyrimidin-4-imine;ethane?
The InChIKey is YSKLYEOSMVJZBP-UHDJGPCESA-N. The full InChI is InChI=1S/C6H9N3.C2H6/c1-7-6-3-4-8-5-9(6)2;1-2/h3-5H,1-2H3;1-2H3/b7-6+;.
What are the key properties of N,3-dimethylpyrimidin-4-imine;ethane?
N,3-dimethylpyrimidin-4-imine;ethane has a molecular weight of 153.23 g/mol, XLogP of 0.98, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethylpyrimidin-4-imine;ethane is sourced from PubChem (CID 143152236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).