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

C15H18N4O — CID 63867774

IUPAC4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine
SMILESCOc1ccc(-c2nc(N)nc(C3CCCC3)n2)cc1
InChIInChI=1S/C15H18N4O/c1-20-12-8-6-11(7-9-12)14-17-13(18-15(16)19-14)10-4-2-3-5-10/h6-10H,2-5H2,1H3,(H2,16,17,18,19)
InChIKeyWPCKKQBQXBRFAJ-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.79
Rot. Bonds3

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

4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine (PubChem CID 63867774) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine
PubChem CID63867774
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine
SMILESCOc1ccc(-c2nc(N)nc(C3CCCC3)n2)cc1
InChIInChI=1S/C15H18N4O/c1-20-12-8-6-11(7-9-12)14-17-13(18-15(16)19-14)10-4-2-3-5-10/h6-10H,2-5H2,1H3,(H2,16,17,18,19)
InChIKeyWPCKKQBQXBRFAJ-UHFFFAOYSA-N
XLogP2.79
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-cycloheptyl-6-(4-methylphenyl)-1,3,5-triazin-2-amine
CID 63867173
4-(4-chlorophenyl)-6-cyclopentyl-1,3,5-triazin-2-amine
CID 63868356
4-cyclopentyl-6-(4-fluoro-3-methoxyphenyl)-1,3,5-triazin-2-amine
CID 107923218
4-cyclohexyl-6-(4-ethylphenyl)-1,3,5-triazin-2-amine
CID 63867166
4-cyclopropyl-6-(4-methylsulfanylphenyl)-1,3,5-triazin-2-amine
CID 106850121
4-cyclohexyl-6-(3-methylphenyl)-1,3,5-triazin-2-amine
CID 63867917
4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine
CID 114520303
4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine
CID 63868741
4-cyclohexyl-6-cyclopentyl-1,3,5-triazin-2-amine
CID 63868885
4-cycloheptyl-6-(6-methyl-2-pyridinyl)-1,3,5-triazin-2-amine
CID 63867330
2,4,6-tris[4-(4-methoxyphenyl)phenyl]-1,3,5-triazine
CID 20652062
4-cyclohexyl-6-(4-methyl-3-pyridinyl)-1,3,5-triazin-2-amine
CID 114879025

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine (CID 63867774) is 4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine is COc1ccc(-c2nc(N)nc(C3CCCC3)n2)cc1.
What is the InChIKey of 4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine?
The InChIKey is WPCKKQBQXBRFAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-20-12-8-6-11(7-9-12)14-17-13(18-15(16)19-14)10-4-2-3-5-10/h6-10H,2-5H2,1H3,(H2,16,17,18,19).
What are the key properties of 4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine?
4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine has a molecular weight of 270.34 g/mol, XLogP of 2.79, 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-methoxyphenyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 63867774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).