4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine

C14H18N4O3 — CID 80865867

IUPAC4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine
SMILESCCCNc1nc(OC)nc(Oc2cccc(OC)c2)n1
InChIInChI=1S/C14H18N4O3/c1-4-8-15-12-16-13(20-3)18-14(17-12)21-11-7-5-6-10(9-11)19-2/h5-7,9H,4,8H2,1-3H3,(H,15,16,17,18)
InChIKeyGMQPUBWKIPBHGM-UHFFFAOYSA-N
MW290.32 g/mol
LogP2.50
Rot. Bonds7

About 4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine

4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine (PubChem CID 80865867) has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is 4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine
PubChem CID80865867
Molecular FormulaC14H18N4O3
Molecular Weight290.32 g/mol
Exact Mass290.14
IUPAC Name4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine
SMILESCCCNc1nc(OC)nc(Oc2cccc(OC)c2)n1
InChIInChI=1S/C14H18N4O3/c1-4-8-15-12-16-13(20-3)18-14(17-12)21-11-7-5-6-10(9-11)19-2/h5-7,9H,4,8H2,1-3H3,(H,15,16,17,18)
InChIKeyGMQPUBWKIPBHGM-UHFFFAOYSA-N
XLogP2.50
TPSA78.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 80869841
4-(3-bromo-4-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 83232385
4-[(5-chloro-3-pyridinyl)oxy]-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 80878172
[4-(3-ethoxyphenoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
CID 80930359
4-(3-chloro-2-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 116691277
2-N,2-N-dimethyl-6-phenoxy-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80869615
6-methoxy-4-N-propyl-2-N-pyridin-3-yl-1,3,5-triazine-2,4-diamine
CID 117092308
4-[(3-chlorophenyl)methoxy]-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 80871605
2,4-dimethoxy-6-(3-methylphenoxy)-1,3,5-triazine
CID 121014438
4-(3-chlorophenyl)sulfanyl-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 80892069
4-(3-bromophenyl)sulfanyl-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 80889128
4-[(2-bromophenyl)methoxy]-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 82808235

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine (CID 80865867) is 4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine is CCCNc1nc(OC)nc(Oc2cccc(OC)c2)n1.
What is the InChIKey of 4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine?
The InChIKey is GMQPUBWKIPBHGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3/c1-4-8-15-12-16-13(20-3)18-14(17-12)21-11-7-5-6-10(9-11)19-2/h5-7,9H,4,8H2,1-3H3,(H,15,16,17,18).
What are the key properties of 4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine?
4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine has a molecular weight of 290.32 g/mol, XLogP of 2.50, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80865867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).