1-ethenyl-N,6-dimethylpyrimidin-2-imine

C8H11N3 — CID 178051810

IUPAC1-ethenyl-N,6-dimethylpyrimidin-2-imine
SMILESC=Cn1c(C)ccn/c1=N\C
InChIInChI=1S/C8H11N3/c1-4-11-7(2)5-6-10-8(11)9-3/h4-6H,1H2,2-3H3/b9-8+
InChIKeyHQHURCGXRHETHJ-CMDGGOBGSA-N
MW149.20 g/mol
LogP0.82
Rot. Bonds1

About 1-ethenyl-N,6-dimethylpyrimidin-2-imine

1-ethenyl-N,6-dimethylpyrimidin-2-imine (PubChem CID 178051810) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is 1-ethenyl-N,6-dimethylpyrimidin-2-imine.

Molecular Properties

Compound Name1-ethenyl-N,6-dimethylpyrimidin-2-imine
PubChem CID178051810
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC Name1-ethenyl-N,6-dimethylpyrimidin-2-imine
SMILESC=Cn1c(C)ccn/c1=N\C
InChIInChI=1S/C8H11N3/c1-4-11-7(2)5-6-10-8(11)9-3/h4-6H,1H2,2-3H3/b9-8+
InChIKeyHQHURCGXRHETHJ-CMDGGOBGSA-N
XLogP0.82
TPSA30.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-Methyl-2(1H)-pyrimidinylidene)methanamine
CID 21719087
Pyrimidine, 2-ethylimino-1,2-dihydro-1-methyl-
CID 89030559
Pyrimidine, 1-ethyl-1,2-dihydro-2-methylimino-
CID 142258453
Pyrimidine, 1,2-dihydro-2-imino-1,6-dimethyl-
CID 171383916
Pyrimidine, 2-allylimino-1,2-dihydro-1-propyl-
CID 171384034
Pyrimidine, 1-butyl-1,2-dihydro-2-methylimino-
CID 171384475
Pyrimidine, 1-allyl-1,2-dihydro-2-propylimino-
CID 171384509
Pyrimidine, 2-butylimino-1,2-dihydro-1-methyl-
CID 171384684
2-Methylidene-1-propan-2-yl-4-tritiopyrimidine
CID 58196187
1-Ethyl-6-methyl-2-methylidenepyrimidine
CID 58719966
N-tert-butyl-1-methylpyrimidin-2-imine
CID 59485550
2-Methylidene-1-propan-2-ylpyrimidine
CID 76721750

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-N,6-dimethylpyrimidin-2-imine?
The IUPAC name of 1-ethenyl-N,6-dimethylpyrimidin-2-imine (CID 178051810) is 1-ethenyl-N,6-dimethylpyrimidin-2-imine.
What is the SMILES notation for 1-ethenyl-N,6-dimethylpyrimidin-2-imine?
The canonical SMILES for 1-ethenyl-N,6-dimethylpyrimidin-2-imine is C=Cn1c(C)ccn/c1=N\C.
What is the InChIKey of 1-ethenyl-N,6-dimethylpyrimidin-2-imine?
The InChIKey is HQHURCGXRHETHJ-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H11N3/c1-4-11-7(2)5-6-10-8(11)9-3/h4-6H,1H2,2-3H3/b9-8+.
What are the key properties of 1-ethenyl-N,6-dimethylpyrimidin-2-imine?
1-ethenyl-N,6-dimethylpyrimidin-2-imine has a molecular weight of 149.20 g/mol, XLogP of 0.82, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-N,6-dimethylpyrimidin-2-imine is sourced from PubChem (CID 178051810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).