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

C13H16N4O — CID 63867600

IUPAC4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine
SMILESCCCc1nc(N)nc(-c2ccccc2OC)n1
InChIInChI=1S/C13H16N4O/c1-3-6-11-15-12(17-13(14)16-11)9-7-4-5-8-10(9)18-2/h4-5,7-8H,3,6H2,1-2H3,(H2,14,15,16,17)
InChIKeyWERGEVCSQYGYGB-UHFFFAOYSA-N
MW244.30 g/mol
LogP2.08
Rot. Bonds4

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

4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine (PubChem CID 63867600) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine
PubChem CID63867600
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine
SMILESCCCc1nc(N)nc(-c2ccccc2OC)n1
InChIInChI=1S/C13H16N4O/c1-3-6-11-15-12(17-13(14)16-11)9-7-4-5-8-10(9)18-2/h4-5,7-8H,3,6H2,1-2H3,(H2,14,15,16,17)
InChIKeyWERGEVCSQYGYGB-UHFFFAOYSA-N
XLogP2.08
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-bromo-4-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine
CID 106951384
4-cyclopropyl-6-(2-methoxyphenyl)-1,3,5-triazin-2-amine
CID 63868741
4-(4-methyl-3-pyridinyl)-6-propyl-1,3,5-triazin-2-amine
CID 114879021
4-(2-bromophenyl)-6-ethyl-1,3,5-triazin-2-amine
CID 63868723
4-(2-fluoro-3-methoxyphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 82792598
6-[2-[2-[2-[2-(4,6-diamino-1,3,5-triazin-2-yl)ethoxy]phenyl]phenoxy]ethyl]-1,3,5-triazine-2,4-diamine
CID 139995577
bis(dodecane);ethane;2-[4-(2-hydroxyphenyl)-6-(2-methoxyphenyl)-1,3,5-triazin-2-yl]phenol;propane
CID 160918309
2-[2-(2-methoxyphenyl)-4-propyl-1,3-thiazol-5-yl]propan-2-amine
CID 82432590
4-(2-ethoxyphenyl)-6-methylsulfanyl-1,3,5-triazin-2-amine
CID 78909366
5-bromo-6-(methoxymethyl)-2-(2-methoxyphenyl)pyrimidin-4-amine
CID 66300553
4-propyl-6-thiophen-3-yl-1,3,5-triazin-2-amine
CID 63867602
4-[4-(2-methoxyphenyl)phenyl]-1,3,5-triazin-2-amine
CID 142791138

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine (CID 63867600) is 4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine is CCCc1nc(N)nc(-c2ccccc2OC)n1.
What is the InChIKey of 4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine?
The InChIKey is WERGEVCSQYGYGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-3-6-11-15-12(17-13(14)16-11)9-7-4-5-8-10(9)18-2/h4-5,7-8H,3,6H2,1-2H3,(H2,14,15,16,17).
What are the key properties of 4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine?
4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine has a molecular weight of 244.30 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 63867600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).