2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide

C110H102N10O13 — CID 159544061

IUPAC2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide
SMILESCCOc1ccccc1COc1ccccc1C(=O)Nc1cccnc1.CCc1ccccc1COc1ccccc1C(=O)Nc1cccnc1.COc1ccc(C)cc1COc1ccccc1C(=O)Nc1cccnc1.Cc1cccc(C)c1COc1ccccc1C(=O)Nc1cccnc1.O=C(Nc1cccnc1)c1ccccc1OCc1ccccc1OCc1ccccc1
InChIInChI=1S/C26H22N2O3.2C21H20N2O3.2C21H20N2O2/c29-26(28-22-12-8-16-27-17-22)23-13-5-7-15-25(23)31-19-21-11-4-6-14-24(21)30-18-20-9-2-1-3-10-20;1-15-9-10-19(25-2)16(12-15)14-26-20-8-4-3-7-18(20)21(24)23-17-6-5-11-22-13-17;1-2-25-19-11-5-3-8-16(19)15-26-20-12-6-4-10-18(20)21(24)23-17-9-7-13-22-14-17;1-15-7-5-8-16(2)19(15)14-25-20-11-4-3-10-18(20)21(24)23-17-9-6-12-22-13-17;1-2-16-8-3-4-9-17(16)15-25-20-12-6-5-11-19(20)21(24)23-18-10-7-13-22-14-18/h1-17H,18-19H2,(H,28,29);3-13H,14H2,1-2H3,(H,23,24);3-14H,2,15H2,1H3,(H,23,24);3-13H,14H2,1-2H3,(H,23,24);3-14H,2,15H2,1H3,(H,23,24)
InChIKeyMEOOIYKBDYSDNW-UHFFFAOYSA-N
MW1772.08 g/mol
LogP23.04
Rot. Bonds32

About 2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide

2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide (PubChem CID 159544061) has the molecular formula C110H102N10O13 and a molecular weight of 1772.08 g/mol. Its IUPAC name is 2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide
PubChem CID159544061
Molecular FormulaC110H102N10O13
Molecular Weight1772.08 g/mol
Exact Mass1770.76
IUPAC Name2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide
SMILESCCOc1ccccc1COc1ccccc1C(=O)Nc1cccnc1.CCc1ccccc1COc1ccccc1C(=O)Nc1cccnc1.COc1ccc(C)cc1COc1ccccc1C(=O)Nc1cccnc1.Cc1cccc(C)c1COc1ccccc1C(=O)Nc1cccnc1.O=C(Nc1cccnc1)c1ccccc1OCc1ccccc1OCc1ccccc1
InChIInChI=1S/C26H22N2O3.2C21H20N2O3.2C21H20N2O2/c29-26(28-22-12-8-16-27-17-22)23-13-5-7-15-25(23)31-19-21-11-4-6-14-24(21)30-18-20-9-2-1-3-10-20;1-15-9-10-19(25-2)16(12-15)14-26-20-8-4-3-7-18(20)21(24)23-17-6-5-11-22-13-17;1-2-25-19-11-5-3-8-16(19)15-26-20-12-6-4-10-18(20)21(24)23-17-9-7-13-22-14-17;1-15-7-5-8-16(2)19(15)14-25-20-11-4-3-10-18(20)21(24)23-17-9-6-12-22-13-17;1-2-16-8-3-4-9-17(16)15-25-20-12-6-5-11-19(20)21(24)23-18-10-7-13-22-14-18/h1-17H,18-19H2,(H,28,29);3-13H,14H2,1-2H3,(H,23,24);3-14H,2,15H2,1H3,(H,23,24);3-13H,14H2,1-2H3,(H,23,24);3-14H,2,15H2,1H3,(H,23,24)
InChIKeyMEOOIYKBDYSDNW-UHFFFAOYSA-N
XLogP23.04
TPSA283.79 Ų
H-Bond Donors5
H-Bond Acceptors18
Rotatable Bonds32
Heavy Atoms133
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001772.08
LogP ≤ 523.04
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1018

Analyze 2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide?
The IUPAC name of 2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide (CID 159544061) is 2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide?
The canonical SMILES for 2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide is CCOc1ccccc1COc1ccccc1C(=O)Nc1cccnc1.CCc1ccccc1COc1ccccc1C(=O)Nc1cccnc1.COc1ccc(C)cc1COc1ccccc1C(=O)Nc1cccnc1.Cc1cccc(C)c1COc1ccccc1C(=O)Nc1cccnc1.O=C(Nc1cccnc1)c1ccccc1OCc1ccccc1OCc1ccccc1.
What is the InChIKey of 2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide?
The InChIKey is MEOOIYKBDYSDNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O3.2C21H20N2O3.2C21H20N2O2/c29-26(28-22-12-8-16-27-17-22)23-13-5-7-15-25(23)31-19-21-11-4-6-14-24(21)30-18-20-9-2-1-3-10-20;1-15-9-10-19(25-2)16(12-15)14-26-20-8-4-3-7-18(20)21(24)23-17-6-5-11-22-13-17;1-2-25-19-11-5-3-8-16(19)15-26-20-12-6-4-10-18(20)21(24)23-17-9-7-13-22-14-17;1-15-7-5-8-16(2)19(15)14-25-20-11-4-3-10-18(20)21(24)23-17-9-6-12-22-13-17;1-2-16-8-3-4-9-17(16)15-25-20-12-6-5-11-19(20)21(24)23-18-10-7-13-22-14-18/h1-17H,18-19H2,(H,28,29);3-13H,14H2,1-2H3,(H,23,24);3-14H,2,15H2,1H3,(H,23,24);3-13H,14H2,1-2H3,(H,23,24);3-14H,2,15H2,1H3,(H,23,24).
What are the key properties of 2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide?
2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide has a molecular weight of 1772.08 g/mol, XLogP of 23.04, 32 rotatable bonds, 5 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-methoxy-5-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-phenylmethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 159544061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).