5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine

C15H24N2O — CID 19839813

IUPAC5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine
SMILESCCCC1CCC(c2ncc(COC)cn2)CC1
InChIInChI=1S/C15H24N2O/c1-3-4-12-5-7-14(8-6-12)15-16-9-13(10-17-15)11-18-2/h9-10,12,14H,3-8,11H2,1-2H3
InChIKeyPBLKQXYWMZBZPS-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.70
Rot. Bonds5

About 5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine

5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine (PubChem CID 19839813) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine.

Molecular Properties

Compound Name5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine
PubChem CID19839813
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine
SMILESCCCC1CCC(c2ncc(COC)cn2)CC1
InChIInChI=1S/C15H24N2O/c1-3-4-12-5-7-14(8-6-12)15-16-9-13(10-17-15)11-18-2/h9-10,12,14H,3-8,11H2,1-2H3
InChIKeyPBLKQXYWMZBZPS-UHFFFAOYSA-N
XLogP3.70
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-2-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]pyrimidine
CID 19839806
1-[2-(4-propylcyclohexyl)pyrimidin-5-yl]propan-2-amine
CID 65401591
2-[4-[2-(4-butylcyclohexyl)ethyl]cyclohexyl]-5-ethylpyrimidine
CID 19839626
[6-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidin-4-yl]hydrazine
CID 65401170
2-[4-[(E)-2-chloroethenyl]cyclohexyl]-5-(4-propylcyclohexyl)pyrimidine
CID 18656269
4-methyl-5-propyl-2-(4-propylcyclohexyl)pyrimidine
CID 70493707
1-[4-methyl-2-(4-propylcyclohexyl)pyrimidin-5-yl]ethanamine
CID 65401995
4-(4-propylcyclohexyl)-1,3,5-triazin-2-amine
CID 65400793
2-cyclopropyl-6-N-methyl-4-N-(4-propylcyclohexyl)pyrimidine-4,6-diamine
CID 80961016
2-cyclohexyl-5-propylpyrimidine
CID 57193046
N-[[2-(4-ethylcyclohexyl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 65391135
2-[4-[(E)-2-chloroethenyl]cyclohexyl]-5-[4-(methoxymethyl)phenyl]pyrimidine
CID 18656291

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine?
The IUPAC name of 5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine (CID 19839813) is 5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine.
What is the SMILES notation for 5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine?
The canonical SMILES for 5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine is CCCC1CCC(c2ncc(COC)cn2)CC1.
What is the InChIKey of 5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine?
The InChIKey is PBLKQXYWMZBZPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-4-12-5-7-14(8-6-12)15-16-9-13(10-17-15)11-18-2/h9-10,12,14H,3-8,11H2,1-2H3.
What are the key properties of 5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine?
5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine has a molecular weight of 248.37 g/mol, XLogP of 3.70, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-2-(4-propylcyclohexyl)pyrimidine is sourced from PubChem (CID 19839813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).