2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane

C12H24N2 — CID 144889370

IUPAC2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane
SMILESCC.CC.CC1C=CNC(C2CC2)=N1
InChIInChI=1S/C8H12N2.2C2H6/c1-6-4-5-9-8(10-6)7-2-3-7;2*1-2/h4-7H,2-3H2,1H3,(H,9,10);2*1-2H3
InChIKeyZDXIZBYTJCPSKW-UHFFFAOYSA-N
MW196.34 g/mol
LogP3.35
Rot. Bonds1

About 2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane

2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane (PubChem CID 144889370) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane.

Molecular Properties

Compound Name2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane
PubChem CID144889370
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane
SMILESCC.CC.CC1C=CNC(C2CC2)=N1
InChIInChI=1S/C8H12N2.2C2H6/c1-6-4-5-9-8(10-6)7-2-3-7;2*1-2/h4-7H,2-3H2,1H3,(H,9,10);2*1-2H3
InChIKeyZDXIZBYTJCPSKW-UHFFFAOYSA-N
XLogP3.35
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane?
The IUPAC name of 2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane (CID 144889370) is 2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane.
What is the SMILES notation for 2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane?
The canonical SMILES for 2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane is CC.CC.CC1C=CNC(C2CC2)=N1.
What is the InChIKey of 2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane?
The InChIKey is ZDXIZBYTJCPSKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2.2C2H6/c1-6-4-5-9-8(10-6)7-2-3-7;2*1-2/h4-7H,2-3H2,1H3,(H,9,10);2*1-2H3.
What are the key properties of 2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane?
2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane has a molecular weight of 196.34 g/mol, XLogP of 3.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-methyl-1,4-dihydropyrimidine;ethane is sourced from PubChem (CID 144889370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).