1-ethyl-6-methyl-2-methylidenepyrimidine

C8H12N2 — CID 58719966

IUPAC1-ethyl-6-methyl-2-methylidenepyrimidine
SMILESC=C1N=CC=C(C)N1CC
InChIInChI=1S/C8H12N2/c1-4-10-7(2)5-6-9-8(10)3/h5-6H,3-4H2,1-2H3
InChIKeyOSHZIJKHBPXCIR-UHFFFAOYSA-N
MW136.20 g/mol
LogP1.77
Rot. Bonds1

About 1-ethyl-6-methyl-2-methylidenepyrimidine

1-ethyl-6-methyl-2-methylidenepyrimidine (PubChem CID 58719966) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is 1-ethyl-6-methyl-2-methylidenepyrimidine.

Molecular Properties

Compound Name1-ethyl-6-methyl-2-methylidenepyrimidine
PubChem CID58719966
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name1-ethyl-6-methyl-2-methylidenepyrimidine
SMILESC=C1N=CC=C(C)N1CC
InChIInChI=1S/C8H12N2/c1-4-10-7(2)5-6-9-8(10)3/h5-6H,3-4H2,1-2H3
InChIKeyOSHZIJKHBPXCIR-UHFFFAOYSA-N
XLogP1.77
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-methyl-2-methylidenepyrimidine?
The IUPAC name of 1-ethyl-6-methyl-2-methylidenepyrimidine (CID 58719966) is 1-ethyl-6-methyl-2-methylidenepyrimidine.
What is the SMILES notation for 1-ethyl-6-methyl-2-methylidenepyrimidine?
The canonical SMILES for 1-ethyl-6-methyl-2-methylidenepyrimidine is C=C1N=CC=C(C)N1CC.
What is the InChIKey of 1-ethyl-6-methyl-2-methylidenepyrimidine?
The InChIKey is OSHZIJKHBPXCIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2/c1-4-10-7(2)5-6-9-8(10)3/h5-6H,3-4H2,1-2H3.
What are the key properties of 1-ethyl-6-methyl-2-methylidenepyrimidine?
1-ethyl-6-methyl-2-methylidenepyrimidine has a molecular weight of 136.20 g/mol, XLogP of 1.77, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-methyl-2-methylidenepyrimidine is sourced from PubChem (CID 58719966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).