4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine

C11H16N4O2 — CID 5246700

IUPAC4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine
SMILESCOC1=NC(n2nc(C)cc2OC)NC(C)=C1
InChIInChI=1S/C11H16N4O2/c1-7-5-9(16-3)13-11(12-7)15-10(17-4)6-8(2)14-15/h5-6,11-12H,1-4H3
InChIKeyXIMAKXLDSIZEQY-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.21
Rot. Bonds2

About 4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine

4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine (PubChem CID 5246700) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is 4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine.

Molecular Properties

Compound Name4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine
PubChem CID5246700
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine
SMILESCOC1=NC(n2nc(C)cc2OC)NC(C)=C1
InChIInChI=1S/C11H16N4O2/c1-7-5-9(16-3)13-11(12-7)15-10(17-4)6-8(2)14-15/h5-6,11-12H,1-4H3
InChIKeyXIMAKXLDSIZEQY-UHFFFAOYSA-N
XLogP1.21
TPSA60.67 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-methoxy-1,3-dimethyl-1H-pyrazole
CID 581065
3-[(1,3-dimethyl-1H-pyrazol-5-yl)oxy]propan-1-amine
CID 81346017
3-((1,3-dimethyl-1H-pyrazol-5-yl)oxy)propan-1-amine dihydrochloride
CID 137943117
3-Methoxy-1,5-dimethyl-1H-pyrazole
CID 23279524
N-hexyl-3-methoxy-5-methylpyrazole-1-carboxamide
CID 132597457
N-hexyl-5-methoxy-3-methylpyrazole-1-carboxamide
CID 134846788
5-Methoxy-3-methyl-1H-pyrazole-1-carboximidamide
CID 19382656
1-(3-methoxy-1-methylpyrazol-5-yl)-N-methylmethanamine
CID 83864165
1-Ethyl-3-methoxy-2,5-dimethylpyrazol-2-ium
CID 121348520
[5-methyl-1-(methylcarbamoyl)pyrazol-3-yl] N-methylcarbamate
CID 129676684
Ethane;3-methoxy-1,5-dimethylpyrazole
CID 143913567
3-Methoxy-1,5-dimethylpyrazole;morpholine
CID 175275780

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine?
The IUPAC name of 4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine (CID 5246700) is 4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine.
What is the SMILES notation for 4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine?
The canonical SMILES for 4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine is COC1=NC(n2nc(C)cc2OC)NC(C)=C1.
What is the InChIKey of 4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine?
The InChIKey is XIMAKXLDSIZEQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-7-5-9(16-3)13-11(12-7)15-10(17-4)6-8(2)14-15/h5-6,11-12H,1-4H3.
What are the key properties of 4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine?
4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine has a molecular weight of 236.27 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methyl-1,2-dihydropyrimidine is sourced from PubChem (CID 5246700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).