2,3,5-trimethylpyrimidin-4-imine

C7H11N3 — CID 134868678

IUPAC2,3,5-trimethylpyrimidin-4-imine
SMILES[H]/N=c1\c(C)cnc(C)n1C
InChIInChI=1S/C7H11N3/c1-5-4-9-6(2)10(3)7(5)8/h4,8H,1-3H3/b8-7+
InChIKeySSBRHHYQHBLXLC-BQYQJAHWSA-N
MW137.19 g/mol
LogP0.52
Rot. Bonds

About 2,3,5-trimethylpyrimidin-4-imine

2,3,5-trimethylpyrimidin-4-imine (PubChem CID 134868678) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is 2,3,5-trimethylpyrimidin-4-imine.

Molecular Properties

Compound Name2,3,5-trimethylpyrimidin-4-imine
PubChem CID134868678
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name2,3,5-trimethylpyrimidin-4-imine
SMILES[H]/N=c1\c(C)cnc(C)n1C
InChIInChI=1S/C7H11N3/c1-5-4-9-6(2)10(3)7(5)8/h4,8H,1-3H3/b8-7+
InChIKeySSBRHHYQHBLXLC-BQYQJAHWSA-N
XLogP0.52
TPSA41.67 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-Ethyl-3-methylpyrimidin-4-imine
CID 134868448
6-Imino-2,5-dimethylpyrimidin-1-amine
CID 68103896
1,2,5-trimethyl-3-methylidene-4H-pyrimidine-1,3-diium
CID 90694123
2,3,5-trimethyl-4H-pyrimidine
CID 90695249
(Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide
CID 118972951
(Z)-3-amino-N-ethyl-N',2-dimethyl-N-propylprop-2-enimidamide
CID 118973186
2,5-Dimethyl-3-prop-1-enylpyrimidin-4-imine
CID 123921657
2,5-dimethyl-3-propyl-4H-pyrimidine
CID 142076733
2,5-dimethyl-4H-pyrimidin-3-ide
CID 145231369
2-Imino-1,5-dimethylpyrimidin-4-amine
CID 147420910
N-ethyl-N,2-dimethylprop-2-enimidamide
CID 175723363
2,3-diethylpyrimidin-4(3H)-imine
CID 13925311

Frequently Asked Questions

What is the IUPAC name of 2,3,5-trimethylpyrimidin-4-imine?
The IUPAC name of 2,3,5-trimethylpyrimidin-4-imine (CID 134868678) is 2,3,5-trimethylpyrimidin-4-imine.
What is the SMILES notation for 2,3,5-trimethylpyrimidin-4-imine?
The canonical SMILES for 2,3,5-trimethylpyrimidin-4-imine is [H]/N=c1\c(C)cnc(C)n1C.
What is the InChIKey of 2,3,5-trimethylpyrimidin-4-imine?
The InChIKey is SSBRHHYQHBLXLC-BQYQJAHWSA-N. The full InChI is InChI=1S/C7H11N3/c1-5-4-9-6(2)10(3)7(5)8/h4,8H,1-3H3/b8-7+.
What are the key properties of 2,3,5-trimethylpyrimidin-4-imine?
2,3,5-trimethylpyrimidin-4-imine has a molecular weight of 137.19 g/mol, XLogP of 0.52, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trimethylpyrimidin-4-imine is sourced from PubChem (CID 134868678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).