4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane

C13H24N2O — CID 177140873

IUPAC4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane
SMILESCC.CC.COc1ncnc(C2CC2)c1C
InChIInChI=1S/C9H12N2O.2C2H6/c1-6-8(7-3-4-7)10-5-11-9(6)12-2;2*1-2/h5,7H,3-4H2,1-2H3;2*1-2H3
InChIKeyYUFPIRRHFJXOTI-UHFFFAOYSA-N
MW224.35 g/mol
LogP3.72
Rot. Bonds2

About 4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane

4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane (PubChem CID 177140873) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane.

Molecular Properties

Compound Name4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane
PubChem CID177140873
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane
SMILESCC.CC.COc1ncnc(C2CC2)c1C
InChIInChI=1S/C9H12N2O.2C2H6/c1-6-8(7-3-4-7)10-5-11-9(6)12-2;2*1-2/h5,7H,3-4H2,1-2H3;2*1-2H3
InChIKeyYUFPIRRHFJXOTI-UHFFFAOYSA-N
XLogP3.72
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-Methoxy-7-(oxolan-3-ylmethyl)-5,6,8,9-tetrahydropyrimido[4,5-d]azepine
CID 118741016
4-(Fluoromethoxy)-6-propan-2-ylpyrimidine
CID 177852945
4-Tert-butyl-6-(difluoromethoxy)pyrimidine
CID 58088151
4-Methoxy-6-propan-2-yl-5-(trifluoromethyl)pyrimidine
CID 58115651
2-Chloro-5-fluoro-4-methoxy-6-propylpyrimidine
CID 58252170
2-Chloro-4-cyclopropyl-5-fluoro-6-methoxypyrimidine
CID 58252174
4-But-2-ynoxy-5-fluoro-6-(3-methylcyclohexyl)pyrimidine
CID 86001386
4-Cyclopropyl-5-fluoro-6-methoxypyrimidin-2-amine
CID 89037245
4-Cyclopropyl-5-fluoro-6-methoxy-2-propan-2-ylpyrimidine
CID 89935529
4-Cyclopropyl-5-fluoro-6-methoxy-2-methylpyrimidine
CID 89945906
4-But-2-ynoxy-5-fluoro-6-propan-2-ylpyrimidine
CID 90716026
4-cyclopropyl-5-fluoro-6-methoxy-N,N-dimethylpyrimidin-2-amine
CID 121478453

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane?
The IUPAC name of 4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane (CID 177140873) is 4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane.
What is the SMILES notation for 4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane?
The canonical SMILES for 4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane is CC.CC.COc1ncnc(C2CC2)c1C.
What is the InChIKey of 4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane?
The InChIKey is YUFPIRRHFJXOTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O.2C2H6/c1-6-8(7-3-4-7)10-5-11-9(6)12-2;2*1-2/h5,7H,3-4H2,1-2H3;2*1-2H3.
What are the key properties of 4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane?
4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane has a molecular weight of 224.35 g/mol, XLogP of 3.72, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-6-methoxy-5-methylpyrimidine;ethane is sourced from PubChem (CID 177140873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).