2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide

C22H21N3O5 — CID 12912868

IUPAC2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide
SMILESCOc1cccc(OC)c1C(=O)NC(=O)Nc1ccc(OCc2ccccc2)nc1
InChIInChI=1S/C22H21N3O5/c1-28-17-9-6-10-18(29-2)20(17)21(26)25-22(27)24-16-11-12-19(23-13-16)30-14-15-7-4-3-5-8-15/h3-13H,14H2,1-2H3,(H2,24,25,26,27)
InChIKeyRBLOEDDKPDATMP-UHFFFAOYSA-N
MW407.43 g/mol
LogP3.64
Rot. Bonds7

About 2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide

2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide (PubChem CID 12912868) has the molecular formula C22H21N3O5 and a molecular weight of 407.43 g/mol. Its IUPAC name is 2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide
PubChem CID12912868
Molecular FormulaC22H21N3O5
Molecular Weight407.43 g/mol
Exact Mass407.15
IUPAC Name2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide
SMILESCOc1cccc(OC)c1C(=O)NC(=O)Nc1ccc(OCc2ccccc2)nc1
InChIInChI=1S/C22H21N3O5/c1-28-17-9-6-10-18(29-2)20(17)21(26)25-22(27)24-16-11-12-19(23-13-16)30-14-15-7-4-3-5-8-15/h3-13H,14H2,1-2H3,(H2,24,25,26,27)
InChIKeyRBLOEDDKPDATMP-UHFFFAOYSA-N
XLogP3.64
TPSA98.78 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.43
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[6-(2,6-dichlorophenoxy)-3-pyridinyl]carbamoyl]-2,6-dimethoxybenzamide
CID 12912829
N-(6-methoxy-3-pyridinyl)-2-phenylmethoxybenzamide
CID 2344191
4-methoxy-3-nitro-N-(6-phenylmethoxy-3-pyridinyl)benzamide
CID 55879438
2-methoxy-N-(4-methoxyphenyl)-6-phenylmethoxybenzamide
CID 44762771
2-bromo-N-(6-phenylmethoxy-3-pyridinyl)benzamide
CID 55879442
N-[[6-[2-fluoro-5-(trifluoromethyl)phenoxy]-3-pyridinyl]carbamoyl]-2,6-dimethoxybenzamide
CID 57224277
2,6-difluoro-N-[(3-methyl-4-phenylmethoxyphenyl)carbamoyl]benzamide
CID 20524527
2-methoxyethyl 2,4-dimethyl-5-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]-1H-pyrrole-3-carboxylate
CID 55879828
N-(6-phenylmethoxy-3-pyridinyl)-4-(tetrazol-1-yl)benzamide
CID 55960600
N-(6-phenylmethoxy-3-pyridinyl)-3-(pyridin-3-ylmethoxy)benzamide
CID 55880084
2-chloro-6-methoxy-N-[[6-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]carbamoyl]benzamide
CID 12912838
5-oxo-N-(6-phenylmethoxy-3-pyridinyl)-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide
CID 55879064

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide?
The IUPAC name of 2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide (CID 12912868) is 2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide?
The canonical SMILES for 2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide is COc1cccc(OC)c1C(=O)NC(=O)Nc1ccc(OCc2ccccc2)nc1.
What is the InChIKey of 2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide?
The InChIKey is RBLOEDDKPDATMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O5/c1-28-17-9-6-10-18(29-2)20(17)21(26)25-22(27)24-16-11-12-19(23-13-16)30-14-15-7-4-3-5-8-15/h3-13H,14H2,1-2H3,(H2,24,25,26,27).
What are the key properties of 2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide?
2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide has a molecular weight of 407.43 g/mol, XLogP of 3.64, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-[(6-phenylmethoxy-3-pyridinyl)carbamoyl]benzamide is sourced from PubChem (CID 12912868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).