ethane;5-methoxy-2-methylpyrimidine

C8H14N2O — CID 143166828

IUPACethane;5-methoxy-2-methylpyrimidine
SMILESCC.COc1cnc(C)nc1
InChIInChI=1S/C6H8N2O.C2H6/c1-5-7-3-6(9-2)4-8-5;1-2/h3-4H,1-2H3;1-2H3
InChIKeyXWHWKWCAHXWNLV-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.82
Rot. Bonds1

About ethane;5-methoxy-2-methylpyrimidine

ethane;5-methoxy-2-methylpyrimidine (PubChem CID 143166828) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is ethane;5-methoxy-2-methylpyrimidine.

Molecular Properties

Compound Nameethane;5-methoxy-2-methylpyrimidine
PubChem CID143166828
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Nameethane;5-methoxy-2-methylpyrimidine
SMILESCC.COc1cnc(C)nc1
InChIInChI=1S/C6H8N2O.C2H6/c1-5-7-3-6(9-2)4-8-5;1-2/h3-4H,1-2H3;1-2H3
InChIKeyXWHWKWCAHXWNLV-UHFFFAOYSA-N
XLogP1.82
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-methoxypyrimidine-2-carbonitrile
CID 3715049
2-(2-methylpyrimidin-5-yl)oxyethanol
CID 117230630
2-(5-methoxypyrimidin-2-yl)propan-2-ol
CID 118346554
ethane;5-methoxy-2,4-dimethylpyrimidine
CID 145013218
5-methoxypyrimidine-2-sulfonamide
CID 12939900
6-methoxy-2-methylquinazoline
CID 54578216
2-(azetidin-1-yl)-5-methoxypyrimidine
CID 163343627
5-methoxy-2-(3-methylphenyl)pyrimidine
CID 91581567
5-methoxy-2-(2-methylpyrimidin-5-yl)benzaldehyde
CID 172651190
ethane;2-fluoro-5-methoxy-3-methylpyridine;2-fluoro-5-methoxy-4-methylpyridine
CID 145346850
3-tert-butyl-5-methoxy-2-methylpyridine
CID 166004066
2-methyl-5-phenylmethoxypyrimidine
CID 59993103

Frequently Asked Questions

What is the IUPAC name of ethane;5-methoxy-2-methylpyrimidine?
The IUPAC name of ethane;5-methoxy-2-methylpyrimidine (CID 143166828) is ethane;5-methoxy-2-methylpyrimidine.
What is the SMILES notation for ethane;5-methoxy-2-methylpyrimidine?
The canonical SMILES for ethane;5-methoxy-2-methylpyrimidine is CC.COc1cnc(C)nc1.
What is the InChIKey of ethane;5-methoxy-2-methylpyrimidine?
The InChIKey is XWHWKWCAHXWNLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O.C2H6/c1-5-7-3-6(9-2)4-8-5;1-2/h3-4H,1-2H3;1-2H3.
What are the key properties of ethane;5-methoxy-2-methylpyrimidine?
ethane;5-methoxy-2-methylpyrimidine has a molecular weight of 154.21 g/mol, XLogP of 1.82, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methoxy-2-methylpyrimidine is sourced from PubChem (CID 143166828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).