2,4-dimethoxy-5-propylpyrimidine

C9H14N2O2 — CID 14135536

IUPAC2,4-dimethoxy-5-propylpyrimidine
SMILESCCCc1cnc(OC)nc1OC
InChIInChI=1S/C9H14N2O2/c1-4-5-7-6-10-9(13-3)11-8(7)12-2/h6H,4-5H2,1-3H3
InChIKeyFTQUPNGDRJZDLI-UHFFFAOYSA-N
MW182.22 g/mol
LogP1.45
Rot. Bonds4

About 2,4-dimethoxy-5-propylpyrimidine

2,4-dimethoxy-5-propylpyrimidine (PubChem CID 14135536) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2,4-dimethoxy-5-propylpyrimidine.

Molecular Properties

Compound Name2,4-dimethoxy-5-propylpyrimidine
PubChem CID14135536
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name2,4-dimethoxy-5-propylpyrimidine
SMILESCCCc1cnc(OC)nc1OC
InChIInChI=1S/C9H14N2O2/c1-4-5-7-6-10-9(13-3)11-8(7)12-2/h6H,4-5H2,1-3H3
InChIKeyFTQUPNGDRJZDLI-UHFFFAOYSA-N
XLogP1.45
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-Dimethoxy-5-methylpyrimidine
CID 579948
2,4-Dimethoxy-5-(nonafluorobutyl)pyrimidine
CID 125484246
2,4-Dimethoxy-5-[2-(methoxymethoxy)ethyl]pyrimidine
CID 57401299
5-Pyrimidineethanol, 2,4-dimethoxy-
CID 15450835
2-(2-Chloro-4-methoxypyrimidin-5-yl)ethanol
CID 57396090
5H-Pyrano[2,3-d]pyrimidine
CID 53439102
2-Chloro-5-(2-fluoroethyl)-4-methoxypyrimidine
CID 57396909
4-Methoxy-5-methylpyrimidine
CID 13861006
1-(2,4-Dimethoxypyrimidin-5-yl)-2,2-dimethylpropan-1-one
CID 101460513
2,4-Dimethoxy-5-(3-methylbut-2-enyl)pyrimidine
CID 121222316
2,4-Diethoxy-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)pyrimidine
CID 86220862
3-(2,4-Dimethoxypyrimidin-5-yl)-2,2,4,4-tetramethylpentan-3-ol
CID 146163918

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-5-propylpyrimidine?
The IUPAC name of 2,4-dimethoxy-5-propylpyrimidine (CID 14135536) is 2,4-dimethoxy-5-propylpyrimidine.
What is the SMILES notation for 2,4-dimethoxy-5-propylpyrimidine?
The canonical SMILES for 2,4-dimethoxy-5-propylpyrimidine is CCCc1cnc(OC)nc1OC.
What is the InChIKey of 2,4-dimethoxy-5-propylpyrimidine?
The InChIKey is FTQUPNGDRJZDLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-4-5-7-6-10-9(13-3)11-8(7)12-2/h6H,4-5H2,1-3H3.
What are the key properties of 2,4-dimethoxy-5-propylpyrimidine?
2,4-dimethoxy-5-propylpyrimidine has a molecular weight of 182.22 g/mol, XLogP of 1.45, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-5-propylpyrimidine is sourced from PubChem (CID 14135536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).