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

C22H23N3O3 — CID 46427160

IUPAC3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
SMILESCOc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1OCc1ccncc1
InChIInChI=1S/C22H23N3O3/c1-25(2)19-6-4-5-17(13-19)22(26)24-18-7-8-20(27-3)21(14-18)28-15-16-9-11-23-12-10-16/h4-14H,15H2,1-3H3,(H,24,26)
InChIKeyYVKILBWTUMLTTN-UHFFFAOYSA-N
MW377.44 g/mol
LogP3.99
Rot. Bonds7

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

3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide (PubChem CID 46427160) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
PubChem CID46427160
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC Name3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
SMILESCOc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1OCc1ccncc1
InChIInChI=1S/C22H23N3O3/c1-25(2)19-6-4-5-17(13-19)22(26)24-18-7-8-20(27-3)21(14-18)28-15-16-9-11-23-12-10-16/h4-14H,15H2,1-3H3,(H,24,26)
InChIKeyYVKILBWTUMLTTN-UHFFFAOYSA-N
XLogP3.99
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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
4-acetamido-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide
CID 43068273
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-methylphenyl)benzamide
CID 87032363
N-[3-[[3-(dimethylamino)benzoyl]amino]phenyl]pyridine-4-carboxamide
CID 55610611
N-[2-(aminomethyl)-5-[[3-(dimethylamino)benzoyl]amino]phenyl]-3,4-dimethoxybenzamide
CID 151119860
N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide
CID 30838314
N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-1-benzofuran-2-carboxamide
CID 43068293
3,4-diethoxy-N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]benzamide
CID 46426672
N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-1,2-dihydroacenaphthylene-5-carboxamide
CID 46480702

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide?
The IUPAC name of 3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide (CID 46427160) is 3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide?
The canonical SMILES for 3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide is COc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1OCc1ccncc1.
What is the InChIKey of 3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide?
The InChIKey is YVKILBWTUMLTTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-25(2)19-6-4-5-17(13-19)22(26)24-18-7-8-20(27-3)21(14-18)28-15-16-9-11-23-12-10-16/h4-14H,15H2,1-3H3,(H,24,26).
What are the key properties of 3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide?
3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide has a molecular weight of 377.44 g/mol, XLogP of 3.99, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]benzamide is sourced from PubChem (CID 46427160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).