N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine

C11H16FN3O — CID 14717234

IUPACN-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine
SMILESCOc1cc(F)nc(NC2CCCCC2)n1
InChIInChI=1S/C11H16FN3O/c1-16-10-7-9(12)14-11(15-10)13-8-5-3-2-4-6-8/h7-8H,2-6H2,1H3,(H,13,14,15)
InChIKeyCZUYFAHEVDWEDU-UHFFFAOYSA-N
MW225.27 g/mol
LogP2.37
Rot. Bonds3

About N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine

N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine (PubChem CID 14717234) has the molecular formula C11H16FN3O and a molecular weight of 225.27 g/mol. Its IUPAC name is N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine
PubChem CID14717234
Molecular FormulaC11H16FN3O
Molecular Weight225.27 g/mol
Exact Mass225.13
IUPAC NameN-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine
SMILESCOc1cc(F)nc(NC2CCCCC2)n1
InChIInChI=1S/C11H16FN3O/c1-16-10-7-9(12)14-11(15-10)13-8-5-3-2-4-6-8/h7-8H,2-6H2,1H3,(H,13,14,15)
InChIKeyCZUYFAHEVDWEDU-UHFFFAOYSA-N
XLogP2.37
TPSA47.04 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 ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-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 N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine?
The IUPAC name of N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine (CID 14717234) is N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine.
What is the SMILES notation for N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine?
The canonical SMILES for N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine is COc1cc(F)nc(NC2CCCCC2)n1.
What is the InChIKey of N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine?
The InChIKey is CZUYFAHEVDWEDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN3O/c1-16-10-7-9(12)14-11(15-10)13-8-5-3-2-4-6-8/h7-8H,2-6H2,1H3,(H,13,14,15).
What are the key properties of N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine?
N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine has a molecular weight of 225.27 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-fluoro-6-methoxypyrimidin-2-amine is sourced from PubChem (CID 14717234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).