6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine

C26H24N2O4 — CID 10137412

IUPAC6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine
SMILESCOc1cc(Nc2cccc(-c3ccccc3Oc3ccccc3)n2)cc(OC)c1OC
InChIInChI=1S/C26H24N2O4/c1-29-23-16-18(17-24(30-2)26(23)31-3)27-25-15-9-13-21(28-25)20-12-7-8-14-22(20)32-19-10-5-4-6-11-19/h4-17H,1-3H3,(H,27,28)
InChIKeyNRZVDQPNUYEOAQ-UHFFFAOYSA-N
MW428.49 g/mol
LogP6.31
Rot. Bonds8

About 6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine

6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine (PubChem CID 10137412) has the molecular formula C26H24N2O4 and a molecular weight of 428.49 g/mol. Its IUPAC name is 6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine
PubChem CID10137412
Molecular FormulaC26H24N2O4
Molecular Weight428.49 g/mol
Exact Mass428.17
IUPAC Name6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine
SMILESCOc1cc(Nc2cccc(-c3ccccc3Oc3ccccc3)n2)cc(OC)c1OC
InChIInChI=1S/C26H24N2O4/c1-29-23-16-18(17-24(30-2)26(23)31-3)27-25-15-9-13-21(28-25)20-12-7-8-14-22(20)32-19-10-5-4-6-11-19/h4-17H,1-3H3,(H,27,28)
InChIKeyNRZVDQPNUYEOAQ-UHFFFAOYSA-N
XLogP6.31
TPSA61.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.49
LogP ≤ 56.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-(3-ethoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine
CID 10110306
N-(3,4,5-trimethoxyphenyl)quinolin-2-amine
CID 57393025
6-(3-phenylphenoxy)-N-(3,4,5-trimethoxyphenyl)pyrazin-2-amine
CID 59343474
6-(2,3-dimethoxyphenyl)-N-ethylpyridin-2-amine
CID 82795148
1-N,2-N-bis(3,4,5-trimethoxyphenyl)benzene-1,2-diamine
CID 171934003
3-[6-(3,4,5-trimethoxyanilino)pyrazin-2-yl]phenol
CID 11595532
2-(2,3-dimethoxyphenyl)-6-(2,4-dimethoxyphenyl)pyridine
CID 90670585
4-N-(2-methoxyphenyl)-6-methyl-2-N-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine
CID 112930468
1-phenyl-3-[4-[6-(3,4,5-trimethoxyanilino)pyrazin-2-yl]oxyphenyl]urea
CID 59343415
2-(2-methoxyphenyl)-6-(6-phenyl-2-pyridinyl)pyridine
CID 23135803
7-pyridin-2-yl-N-(3,4,5-trimethoxyphenyl)-1,3-benzoxazol-2-amine
CID 24801650
5-N-(2-methoxyphenyl)-3-N-(3,4,5-trimethoxyphenyl)-1,2,4-triazine-3,5-diamine
CID 112967104

Frequently Asked Questions

What is the IUPAC name of 6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine?
The IUPAC name of 6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine (CID 10137412) is 6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine.
What is the SMILES notation for 6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine?
The canonical SMILES for 6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine is COc1cc(Nc2cccc(-c3ccccc3Oc3ccccc3)n2)cc(OC)c1OC.
What is the InChIKey of 6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine?
The InChIKey is NRZVDQPNUYEOAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O4/c1-29-23-16-18(17-24(30-2)26(23)31-3)27-25-15-9-13-21(28-25)20-12-7-8-14-22(20)32-19-10-5-4-6-11-19/h4-17H,1-3H3,(H,27,28).
What are the key properties of 6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine?
6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine has a molecular weight of 428.49 g/mol, XLogP of 6.31, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-phenoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine is sourced from PubChem (CID 10137412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).