5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine

C10H16N2 — CID 18740808

IUPAC5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine
SMILESCC=C(C)C1=CN(C)C(C)=NC1
InChIInChI=1S/C10H16N2/c1-5-8(2)10-6-11-9(3)12(4)7-10/h5,7H,6H2,1-4H3
InChIKeyULBVHQGJCZFFLV-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.20
Rot. Bonds1

About 5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine

5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine (PubChem CID 18740808) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine.

Molecular Properties

Compound Name5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine
PubChem CID18740808
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine
SMILESCC=C(C)C1=CN(C)C(C)=NC1
InChIInChI=1S/C10H16N2/c1-5-8(2)10-6-11-9(3)12(4)7-10/h5,7H,6H2,1-4H3
InChIKeyULBVHQGJCZFFLV-UHFFFAOYSA-N
XLogP2.20
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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2-ethenyl-N-methylisoquinolin-3-imine
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1-ethenyl-N,5-dimethylpyridin-2-imine
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1-ethenyl-N,4-dimethylpyridin-2-imine
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N,1,5-trimethylpyridin-2-imine
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Frequently Asked Questions

What is the IUPAC name of 5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine?
The IUPAC name of 5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine (CID 18740808) is 5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine.
What is the SMILES notation for 5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine?
The canonical SMILES for 5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine is CC=C(C)C1=CN(C)C(C)=NC1.
What is the InChIKey of 5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine?
The InChIKey is ULBVHQGJCZFFLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-5-8(2)10-6-11-9(3)12(4)7-10/h5,7H,6H2,1-4H3.
What are the key properties of 5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine?
5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine has a molecular weight of 164.25 g/mol, XLogP of 2.20, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-but-2-en-2-yl-1,2-dimethyl-4H-pyrimidine is sourced from PubChem (CID 18740808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).