2-cyclohexyloxy-4,5-dimethylpyrimidine

C12H18N2O — CID 150119651

IUPAC2-cyclohexyloxy-4,5-dimethylpyrimidine
SMILESCc1cnc(OC2CCCCC2)nc1C
InChIInChI=1S/C12H18N2O/c1-9-8-13-12(14-10(9)2)15-11-6-4-3-5-7-11/h8,11H,3-7H2,1-2H3
InChIKeyDYZAFGQTDNMQCP-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.80
Rot. Bonds2

About 2-cyclohexyloxy-4,5-dimethylpyrimidine

2-cyclohexyloxy-4,5-dimethylpyrimidine (PubChem CID 150119651) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-cyclohexyloxy-4,5-dimethylpyrimidine.

Molecular Properties

Compound Name2-cyclohexyloxy-4,5-dimethylpyrimidine
PubChem CID150119651
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-cyclohexyloxy-4,5-dimethylpyrimidine
SMILESCc1cnc(OC2CCCCC2)nc1C
InChIInChI=1S/C12H18N2O/c1-9-8-13-12(14-10(9)2)15-11-6-4-3-5-7-11/h8,11H,3-7H2,1-2H3
InChIKeyDYZAFGQTDNMQCP-UHFFFAOYSA-N
XLogP2.80
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-4,5-dimethylpyrimidine?
The IUPAC name of 2-cyclohexyloxy-4,5-dimethylpyrimidine (CID 150119651) is 2-cyclohexyloxy-4,5-dimethylpyrimidine.
What is the SMILES notation for 2-cyclohexyloxy-4,5-dimethylpyrimidine?
The canonical SMILES for 2-cyclohexyloxy-4,5-dimethylpyrimidine is Cc1cnc(OC2CCCCC2)nc1C.
What is the InChIKey of 2-cyclohexyloxy-4,5-dimethylpyrimidine?
The InChIKey is DYZAFGQTDNMQCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9-8-13-12(14-10(9)2)15-11-6-4-3-5-7-11/h8,11H,3-7H2,1-2H3.
What are the key properties of 2-cyclohexyloxy-4,5-dimethylpyrimidine?
2-cyclohexyloxy-4,5-dimethylpyrimidine has a molecular weight of 206.29 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-4,5-dimethylpyrimidine is sourced from PubChem (CID 150119651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).