4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide

C22H21N3O4 — CID 43068273

IUPAC4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
SMILESCOc1ccc(NC(=O)c2ccc(NC(C)=O)cc2)cc1OCc1ccncc1
InChIInChI=1S/C22H21N3O4/c1-15(26)24-18-5-3-17(4-6-18)22(27)25-19-7-8-20(28-2)21(13-19)29-14-16-9-11-23-12-10-16/h3-13H,14H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyCJSQBTNGRLZAFT-UHFFFAOYSA-N
MW391.43 g/mol
LogP3.88
Rot. Bonds7

About 4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide

4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide (PubChem CID 43068273) has the molecular formula C22H21N3O4 and a molecular weight of 391.43 g/mol. Its IUPAC name is 4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide.

Molecular Properties

Compound Name4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
PubChem CID43068273
Molecular FormulaC22H21N3O4
Molecular Weight391.43 g/mol
Exact Mass391.15
IUPAC Name4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
SMILESCOc1ccc(NC(=O)c2ccc(NC(C)=O)cc2)cc1OCc1ccncc1
InChIInChI=1S/C22H21N3O4/c1-15(26)24-18-5-3-17(4-6-18)22(27)25-19-7-8-20(28-2)21(13-19)29-14-16-9-11-23-12-10-16/h3-13H,14H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyCJSQBTNGRLZAFT-UHFFFAOYSA-N
XLogP3.88
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.43
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-dichloro-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
CID 46427791
3,5-dichloro-4-methoxy-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
CID 46448262
3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
CID 46427160
N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-3-(trifluoromethyl)benzamide
CID 33128215
N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-3-propoxybenzamide
CID 55778341
3,4-dimethoxy-N-[4-(pyridin-4-ylmethylamino)phenyl]benzamide
CID 112983135
N-[2-[4-methoxy-3-(pyridin-4-ylmethoxy)anilino]-2-oxoethyl]-4-phenylbenzamide
CID 38629097
4-tert-butyl-N-[1-[4-methoxy-3-(pyridin-4-ylmethoxy)anilino]-1-oxopropan-2-yl]benzamide
CID 55679486
N-[4-[(3-amino-4-pyridinyl)oxymethyl]phenyl]-3,4-dimethoxybenzamide
CID 143408520
3,4-diethoxy-N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]benzamide
CID 46426672
N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-1-benzofuran-2-carboxamide
CID 43068293
2-methoxy-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-5-nitrobenzamide
CID 46426545

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide?
The IUPAC name of 4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide (CID 43068273) is 4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide.
What is the SMILES notation for 4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide?
The canonical SMILES for 4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide is COc1ccc(NC(=O)c2ccc(NC(C)=O)cc2)cc1OCc1ccncc1.
What is the InChIKey of 4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide?
The InChIKey is CJSQBTNGRLZAFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O4/c1-15(26)24-18-5-3-17(4-6-18)22(27)25-19-7-8-20(28-2)21(13-19)29-14-16-9-11-23-12-10-16/h3-13H,14H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of 4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide?
4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide has a molecular weight of 391.43 g/mol, XLogP of 3.88, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide is sourced from PubChem (CID 43068273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).