4-(cyclohexylmethoxy)pyrimidine

C11H16N2O — CID 138454370

IUPAC4-(cyclohexylmethoxy)pyrimidine
SMILESc1cc(OCC2CCCCC2)ncn1
InChIInChI=1S/C11H16N2O/c1-2-4-10(5-3-1)8-14-11-6-7-12-9-13-11/h6-7,9-10H,1-5,8H2
InChIKeyOEHLKVXITFGUIC-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.44
Rot. Bonds3

About 4-(cyclohexylmethoxy)pyrimidine

4-(cyclohexylmethoxy)pyrimidine (PubChem CID 138454370) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 4-(cyclohexylmethoxy)pyrimidine.

Molecular Properties

Compound Name4-(cyclohexylmethoxy)pyrimidine
PubChem CID138454370
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name4-(cyclohexylmethoxy)pyrimidine
SMILESc1cc(OCC2CCCCC2)ncn1
InChIInChI=1S/C11H16N2O/c1-2-4-10(5-3-1)8-14-11-6-7-12-9-13-11/h6-7,9-10H,1-5,8H2
InChIKeyOEHLKVXITFGUIC-UHFFFAOYSA-N
XLogP2.44
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 ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

CID 122536474
CID 122536474
CID 398147
CID 398147
CID 224854
CID 224854
CID 51063929
CID 51063929
CID 901709
CID 901709
CID 12244941
CID 12244941
CID 21524439
CID 21524439
CID 259160
CID 259160
CID 80876113
CID 80876113
CID 80880310
CID 80880310
CID 54067963
CID 54067963
CID 125447536
CID 125447536

Frequently Asked Questions

What is the IUPAC name of 4-(cyclohexylmethoxy)pyrimidine?
The IUPAC name of 4-(cyclohexylmethoxy)pyrimidine (CID 138454370) is 4-(cyclohexylmethoxy)pyrimidine.
What is the SMILES notation for 4-(cyclohexylmethoxy)pyrimidine?
The canonical SMILES for 4-(cyclohexylmethoxy)pyrimidine is c1cc(OCC2CCCCC2)ncn1.
What is the InChIKey of 4-(cyclohexylmethoxy)pyrimidine?
The InChIKey is OEHLKVXITFGUIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-2-4-10(5-3-1)8-14-11-6-7-12-9-13-11/h6-7,9-10H,1-5,8H2.
What are the key properties of 4-(cyclohexylmethoxy)pyrimidine?
4-(cyclohexylmethoxy)pyrimidine has a molecular weight of 192.26 g/mol, XLogP of 2.44, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclohexylmethoxy)pyrimidine is sourced from PubChem (CID 138454370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).