4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine

C15H17FN4O — CID 107923218

IUPAC4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine
SMILESCOc1cc(-c2nc(N)nc(C3CCCC3)n2)ccc1F
InChIInChI=1S/C15H17FN4O/c1-21-12-8-10(6-7-11(12)16)14-18-13(19-15(17)20-14)9-4-2-3-5-9/h6-9H,2-5H2,1H3,(H2,17,18,19,20)
InChIKeyDJXMWJYGANPTGR-UHFFFAOYSA-N
MW288.33 g/mol
LogP2.93
Rot. Bonds3

About 4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine

4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine (PubChem CID 107923218) has the molecular formula C15H17FN4O and a molecular weight of 288.33 g/mol. Its IUPAC name is 4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine
PubChem CID107923218
Molecular FormulaC15H17FN4O
Molecular Weight288.33 g/mol
Exact Mass288.14
IUPAC Name4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine
SMILESCOc1cc(-c2nc(N)nc(C3CCCC3)n2)ccc1F
InChIInChI=1S/C15H17FN4O/c1-21-12-8-10(6-7-11(12)16)14-18-13(19-15(17)20-14)9-4-2-3-5-9/h6-9H,2-5H2,1H3,(H2,17,18,19,20)
InChIKeyDJXMWJYGANPTGR-UHFFFAOYSA-N
XLogP2.93
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-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

Related Compounds

4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine
CID 63867774
4-(4-chlorophenyl)-6-cyclopentyl-1,3,5-triazin-2-amine
CID 63868356
4-cycloheptyl-6-(4-methylphenyl)-1,3,5-triazin-2-amine
CID 63867173
4-cyclohexyl-6-(3-methylphenyl)-1,3,5-triazin-2-amine
CID 63867917
4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine
CID 63868741
4-cyclohexyl-6-(4-ethylphenyl)-1,3,5-triazin-2-amine
CID 63867166
2-(4-fluoro-3-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 107922821
4-cyclopropyl-6-(3-fluorophenyl)-1,3,5-triazin-2-amine
CID 63868480
2-(4-fluoro-3-methoxyphenyl)-6-(methoxymethyl)pyrimidin-4-amine
CID 107922852
4-cyclopropyl-6-(4-methylsulfanylphenyl)-1,3,5-triazin-2-amine
CID 106850121
2-(4-fluoro-3-methoxyphenyl)pyrimidin-5-amine
CID 107922532
4-cyclopentyl-2-(4-fluoro-3-methoxyphenyl)-1H-pyrimidin-6-one
CID 136889687

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine (CID 107923218) is 4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine is COc1cc(-c2nc(N)nc(C3CCCC3)n2)ccc1F.
What is the InChIKey of 4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine?
The InChIKey is DJXMWJYGANPTGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN4O/c1-21-12-8-10(6-7-11(12)16)14-18-13(19-15(17)20-14)9-4-2-3-5-9/h6-9H,2-5H2,1H3,(H2,17,18,19,20).
What are the key properties of 4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine?
4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine has a molecular weight of 288.33 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 107923218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).