4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine

C13H14N4O2 — CID 114520303

IUPAC4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine
SMILESCOc1nc(N)nc(-c2ccc(OC3CC3)cc2)n1
InChIInChI=1S/C13H14N4O2/c1-18-13-16-11(15-12(14)17-13)8-2-4-9(5-3-8)19-10-6-7-10/h2-5,10H,6-7H2,1H3,(H2,14,15,16,17)
InChIKeyCJSAJZSBELHSOW-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.67
Rot. Bonds4

About 4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine

4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine (PubChem CID 114520303) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine
PubChem CID114520303
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine
SMILESCOc1nc(N)nc(-c2ccc(OC3CC3)cc2)n1
InChIInChI=1S/C13H14N4O2/c1-18-13-16-11(15-12(14)17-13)8-2-4-9(5-3-8)19-10-6-7-10/h2-5,10H,6-7H2,1H3,(H2,14,15,16,17)
InChIKeyCJSAJZSBELHSOW-UHFFFAOYSA-N
XLogP1.67
TPSA83.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-methoxy-6-(4-methylphenyl)-1,3,5-triazin-2-amine;hydrochloride
CID 175949920
4-cyclopentyl-6-(4-methoxyphenyl)-1,3,5-triazin-2-amine
CID 63867774
4-(4-cyclopropyloxyphenyl)aniline
CID 114519885
4-(4-methoxyphenoxy)cyclohexan-1-amine
CID 16756065
4-methoxy-6-(4-methylphenoxy)-1,3,5-triazin-2-amine
CID 80862927
2-(4-cyclopentyloxyphenyl)pyrimidin-5-amine
CID 82299238
3-(4-cyclopropyloxyphenyl)-5,6-dimethylpyrazin-2-amine
CID 114520332
5-(4-cyclopropyloxyphenyl)pyridin-2-amine
CID 114519908
4-(4-methoxyphenyl)-6-propyl-1,3,5-triazin-2-amine
CID 55250868
4-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]benzamide
CID 80881678
2,4,6-tris[4-(4-methoxyphenyl)phenyl]-1,3,5-triazine
CID 20652062
4-[4-(cyclopropylamino)-6-methoxy-1,3,5-triazin-2-yl]benzamide
CID 117092347

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine (CID 114520303) is 4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine is COc1nc(N)nc(-c2ccc(OC3CC3)cc2)n1.
What is the InChIKey of 4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine?
The InChIKey is CJSAJZSBELHSOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-18-13-16-11(15-12(14)17-13)8-2-4-9(5-3-8)19-10-6-7-10/h2-5,10H,6-7H2,1H3,(H2,14,15,16,17).
What are the key properties of 4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine?
4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine has a molecular weight of 258.28 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclopropyloxyphenyl)-6-methoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 114520303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).