N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide

C21H20N2O3 — CID 110360620

IUPACN-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide
SMILESCOc1ccc(N(Cc2cccnc2)C(=O)COc2ccccc2)cc1
InChIInChI=1S/C21H20N2O3/c1-25-19-11-9-18(10-12-19)23(15-17-6-5-13-22-14-17)21(24)16-26-20-7-3-2-4-8-20/h2-14H,15-16H2,1H3
InChIKeyPMGLPXVTMGKZCB-UHFFFAOYSA-N
MW348.40 g/mol
LogP3.70
Rot. Bonds7

About N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide

N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide (PubChem CID 110360620) has the molecular formula C21H20N2O3 and a molecular weight of 348.40 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide
PubChem CID110360620
Molecular FormulaC21H20N2O3
Molecular Weight348.40 g/mol
Exact Mass348.15
IUPAC NameN-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide
SMILESCOc1ccc(N(Cc2cccnc2)C(=O)COc2ccccc2)cc1
InChIInChI=1S/C21H20N2O3/c1-25-19-11-9-18(10-12-19)23(15-17-6-5-13-22-14-17)21(24)16-26-20-7-3-2-4-8-20/h2-14H,15-16H2,1H3
InChIKeyPMGLPXVTMGKZCB-UHFFFAOYSA-N
XLogP3.70
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluorophenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide
CID 13304879
phenyl N-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)carbamate
CID 110360643
N-(4-methoxyphenyl)-3-methyl-N-(pyridin-3-ylmethyl)butanamide
CID 110360592
N-(4-fluorophenyl)-2-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 110360820
ethyl 4-[[2-(4-chlorophenoxy)acetyl]-(pyridin-3-ylmethyl)amino]benzoate
CID 22778176
ethyl 4-[[2-(4-bromophenoxy)acetyl]-(pyridin-3-ylmethyl)amino]benzoate
CID 23096487
N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide
CID 40508156
N-(1,3-benzothiazol-2-yl)-2-(3-methoxyphenoxy)-N-(pyridin-3-ylmethyl)acetamide
CID 43966667
N-(1,3-benzothiazol-2-yl)-2-(4-methylphenoxy)-N-(pyridin-3-ylmethyl)acetamide
CID 43967194
N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-2-(4-methoxyphenoxy)-N-(pyridin-3-ylmethyl)acetamide
CID 43966712
N-ethyl-2-(4-methoxyphenoxy)-N-phenylacetamide
CID 922695
2-phenyl-N-(pyridin-3-ylmethyl)-N-[4-(quinolin-2-ylmethoxy)phenyl]acetamide
CID 54575104

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide (CID 110360620) is N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide is COc1ccc(N(Cc2cccnc2)C(=O)COc2ccccc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide?
The InChIKey is PMGLPXVTMGKZCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3/c1-25-19-11-9-18(10-12-19)23(15-17-6-5-13-22-14-17)21(24)16-26-20-7-3-2-4-8-20/h2-14H,15-16H2,1H3.
What are the key properties of N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide?
N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide has a molecular weight of 348.40 g/mol, XLogP of 3.70, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide is sourced from PubChem (CID 110360620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).