6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine

C19H22N6O2 — CID 67016106

IUPAC6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine
SMILESCCOc1nc(Nc2ccc(OC)cc2)nc(NC(C)c2ccccn2)n1
InChIInChI=1S/C19H22N6O2/c1-4-27-19-24-17(21-13(2)16-7-5-6-12-20-16)23-18(25-19)22-14-8-10-15(26-3)11-9-14/h5-13H,4H2,1-3H3,(H2,21,22,23,24,25)
InChIKeyRDYCUHGUKIGTNY-UHFFFAOYSA-N
MW366.43 g/mol
LogP3.59
Rot. Bonds8

About 6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine

6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine (PubChem CID 67016106) has the molecular formula C19H22N6O2 and a molecular weight of 366.43 g/mol. Its IUPAC name is 6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine
PubChem CID67016106
Molecular FormulaC19H22N6O2
Molecular Weight366.43 g/mol
Exact Mass366.18
IUPAC Name6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine
SMILESCCOc1nc(Nc2ccc(OC)cc2)nc(NC(C)c2ccccn2)n1
InChIInChI=1S/C19H22N6O2/c1-4-27-19-24-17(21-13(2)16-7-5-6-12-20-16)23-18(25-19)22-14-8-10-15(26-3)11-9-14/h5-13H,4H2,1-3H3,(H2,21,22,23,24,25)
InChIKeyRDYCUHGUKIGTNY-UHFFFAOYSA-N
XLogP3.59
TPSA94.08 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.43
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

4-ethoxy-3-methoxy-N-(1-pyridin-2-ylethyl)aniline
CID 43717313
3-ethoxy-4-methoxy-N-(1-pyridin-2-ylethyl)aniline
CID 43729895
3-methoxy-N-(1-pyridin-2-ylethyl)aniline
CID 43196359
2-ethoxy-4-N-(1-pyridin-2-ylethyl)benzene-1,4-diamine
CID 63671320
2-N-(4-methoxyphenyl)-4-N-methyl-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80758431
3-chloro-4-ethoxy-N-(1-pyridin-2-ylethyl)aniline
CID 54863996
N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
CID 81393069
2-ethoxy-N-(1-pyridin-2-ylethyl)aniline
CID 43191702
2-[4-(1-pyridin-2-ylethylamino)phenoxy]acetamide
CID 43711075
2-ethoxy-N-(1-pyridin-2-ylethyl)pyridin-3-amine
CID 43706285
2-N-[1-(2-chlorophenyl)ethyl]-6-ethoxy-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80784410
4-ethoxy-6-hydrazinyl-N-(1-pyridin-3-ylethyl)-1,3,5-triazin-2-amine
CID 80906443

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine (CID 67016106) is 6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine is CCOc1nc(Nc2ccc(OC)cc2)nc(NC(C)c2ccccn2)n1.
What is the InChIKey of 6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is RDYCUHGUKIGTNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O2/c1-4-27-19-24-17(21-13(2)16-7-5-6-12-20-16)23-18(25-19)22-14-8-10-15(26-3)11-9-14/h5-13H,4H2,1-3H3,(H2,21,22,23,24,25).
What are the key properties of 6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine?
6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 366.43 g/mol, XLogP of 3.59, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-4-N-(4-methoxyphenyl)-2-N-(1-pyridin-2-ylethyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 67016106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).