6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine

C11H16FN3O — CID 11816971

IUPAC6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine
SMILESNc1cc(OCC2CCCCC2)nc(F)n1
InChIInChI=1S/C11H16FN3O/c12-11-14-9(13)6-10(15-11)16-7-8-4-2-1-3-5-8/h6,8H,1-5,7H2,(H2,13,14,15)
InChIKeyLOLBDHAAGYZTPU-UHFFFAOYSA-N
MW225.27 g/mol
LogP2.16
Rot. Bonds3

About 6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine

6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine (PubChem CID 11816971) has the molecular formula C11H16FN3O and a molecular weight of 225.27 g/mol. Its IUPAC name is 6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine.

Molecular Properties

Compound Name6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine
PubChem CID11816971
Molecular FormulaC11H16FN3O
Molecular Weight225.27 g/mol
Exact Mass225.13
IUPAC Name6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine
SMILESNc1cc(OCC2CCCCC2)nc(F)n1
InChIInChI=1S/C11H16FN3O/c12-11-14-9(13)6-10(15-11)16-7-8-4-2-1-3-5-8/h6,8H,1-5,7H2,(H2,13,14,15)
InChIKeyLOLBDHAAGYZTPU-UHFFFAOYSA-N
XLogP2.16
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine?
The IUPAC name of 6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine (CID 11816971) is 6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine.
What is the SMILES notation for 6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine?
The canonical SMILES for 6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine is Nc1cc(OCC2CCCCC2)nc(F)n1.
What is the InChIKey of 6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine?
The InChIKey is LOLBDHAAGYZTPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN3O/c12-11-14-9(13)6-10(15-11)16-7-8-4-2-1-3-5-8/h6,8H,1-5,7H2,(H2,13,14,15).
What are the key properties of 6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine?
6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine has a molecular weight of 225.27 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclohexylmethoxy)-2-fluoropyrimidin-4-amine is sourced from PubChem (CID 11816971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).