4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine

C14H18N4O2 — CID 80859517

IUPAC4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(N)nc(OC(C)c2ccccc2)n1
InChIInChI=1S/C14H18N4O2/c1-3-9-19-13-16-12(15)17-14(18-13)20-10(2)11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H2,15,16,17,18)
InChIKeyGYEDZBYKSNJYIA-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.38
Rot. Bonds6

About 4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine

4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine (PubChem CID 80859517) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine
PubChem CID80859517
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(N)nc(OC(C)c2ccccc2)n1
InChIInChI=1S/C14H18N4O2/c1-3-9-19-13-16-12(15)17-14(18-13)20-10(2)11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H2,15,16,17,18)
InChIKeyGYEDZBYKSNJYIA-UHFFFAOYSA-N
XLogP2.38
TPSA83.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(3-methylbutoxy)-6-propoxy-1,3,5-triazin-2-amine
CID 80858156
4-[2-(2-methylpropoxy)ethoxy]-6-propoxy-1,3,5-triazin-2-amine
CID 106451498
4-(4-propan-2-ylphenyl)sulfanyl-6-propoxy-1,3,5-triazin-2-amine
CID 80872646
4-propoxy-6-(2-thiophen-2-ylethoxy)-1,3,5-triazin-2-amine
CID 80873586
2-N-[1-(2-methylphenyl)ethyl]-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80783677
2-N-butan-2-yl-2-N-methyl-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80775578
6-benzhydryloxy-1,3,5-triazine-2,4-diamine
CID 71405341
4-but-3-ynoxy-6-propoxy-1,3,5-triazin-2-amine
CID 106795654
4-(3-bromophenoxy)-6-propoxy-1,3,5-triazin-2-amine
CID 80870082
4-(3-methylbutan-2-ylsulfanyl)-6-propoxy-1,3,5-triazin-2-amine
CID 107765495
2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine
CID 80941044
2-methoxy-6-(1-phenylethoxy)pyridin-3-amine
CID 43262353

Frequently Asked Questions

What is the IUPAC name of 4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine (CID 80859517) is 4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine is CCCOc1nc(N)nc(OC(C)c2ccccc2)n1.
What is the InChIKey of 4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine?
The InChIKey is GYEDZBYKSNJYIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-3-9-19-13-16-12(15)17-14(18-13)20-10(2)11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H2,15,16,17,18).
What are the key properties of 4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine?
4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine has a molecular weight of 274.32 g/mol, XLogP of 2.38, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80859517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).