2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine

C11H16N2O — CID 139361220

IUPAC2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine
SMILESCOc1cc(C(C)C)nc(C2CC2)n1
InChIInChI=1S/C11H16N2O/c1-7(2)9-6-10(14-3)13-11(12-9)8-4-5-8/h6-8H,4-5H2,1-3H3
InChIKeyWSIZLSZYDMKNFQ-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.49
Rot. Bonds3

About 2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine

2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine (PubChem CID 139361220) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine.

Molecular Properties

Compound Name2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine
PubChem CID139361220
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine
SMILESCOc1cc(C(C)C)nc(C2CC2)n1
InChIInChI=1S/C11H16N2O/c1-7(2)9-6-10(14-3)13-11(12-9)8-4-5-8/h6-8H,4-5H2,1-3H3
InChIKeyWSIZLSZYDMKNFQ-UHFFFAOYSA-N
XLogP2.49
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-Methoxy-2,6-dimethylpyrimidine
CID 12387338
US10358435, Example 1
CID 122539185
2,4-Diisobutoxy-6-(3-methyl-butyl)-pyrimidine
CID 25128805
US10358435, Example 2
CID 122539032
4-(Fluoromethoxy)-6-propan-2-ylpyrimidine
CID 177852945
4-Ethoxy-6-ethylpyrimidin-2-amine
CID 119085413
Pyrimidine, 4-ethoxy-6-methyl-2-(1-methylethyl)-
CID 155747
[6-Cyclopropyl-2-(trifluoromethyl)pyrimidin-4-yl]oxy-diethoxy-sulfanylidene-lambda5-phosphane
CID 13713173
4-Tert-butyl-6-(difluoromethoxy)pyrimidine
CID 58088151
2-Chloro-4-cyclopropyl-5-fluoro-6-methoxypyrimidine
CID 58252174
4-(Difluoromethoxy)-6-ethylpyrimidine
CID 68085724
4-Cyclopropyl-5-fluoro-6-methoxypyrimidin-2-amine
CID 89037245

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine?
The IUPAC name of 2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine (CID 139361220) is 2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine.
What is the SMILES notation for 2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine?
The canonical SMILES for 2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine is COc1cc(C(C)C)nc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine?
The InChIKey is WSIZLSZYDMKNFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-7(2)9-6-10(14-3)13-11(12-9)8-4-5-8/h6-8H,4-5H2,1-3H3.
What are the key properties of 2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine?
2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine has a molecular weight of 192.26 g/mol, XLogP of 2.49, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-methoxy-6-propan-2-ylpyrimidine is sourced from PubChem (CID 139361220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).