4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide

C22H21NO3 — CID 122195803

IUPAC4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide
SMILESCOc1ccc(OCc2ccc(C(=O)N(C)c3ccccc3)cc2)cc1
InChIInChI=1S/C22H21NO3/c1-23(19-6-4-3-5-7-19)22(24)18-10-8-17(9-11-18)16-26-21-14-12-20(25-2)13-15-21/h3-15H,16H2,1-2H3
InChIKeyFAFDEROQJUNETC-UHFFFAOYSA-N
MW347.41 g/mol
LogP4.55
Rot. Bonds6

About 4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide

4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide (PubChem CID 122195803) has the molecular formula C22H21NO3 and a molecular weight of 347.41 g/mol. Its IUPAC name is 4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide.

Molecular Properties

Compound Name4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide
PubChem CID122195803
Molecular FormulaC22H21NO3
Molecular Weight347.41 g/mol
Exact Mass347.15
IUPAC Name4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide
SMILESCOc1ccc(OCc2ccc(C(=O)N(C)c3ccccc3)cc2)cc1
InChIInChI=1S/C22H21NO3/c1-23(19-6-4-3-5-7-19)22(24)18-10-8-17(9-11-18)16-26-21-14-12-20(25-2)13-15-21/h3-15H,16H2,1-2H3
InChIKeyFAFDEROQJUNETC-UHFFFAOYSA-N
XLogP4.55
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.41
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-(4-methoxyphenoxy)acetyl]amino]-N-methyl-N-phenylbenzamide
CID 17230196
4-[(3-formylphenoxy)methyl]-N-methyl-N-phenylbenzamide
CID 139661611
2-(4-methoxyphenyl)-1-(4-phenylmethoxyphenyl)ethanone
CID 18923783
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
4-[(4-ethoxyanilino)methyl]-N-methyl-N-phenylbenzamide
CID 122195977
4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide
CID 23508483
4-(methoxymethyl)-N-methyl-N-naphthalen-2-ylbenzamide
CID 51175212
N,N-diethyl-4-phenylmethoxybenzamide
CID 4958372
4-[[2-(4-ethylphenoxy)acetyl]amino]-N-methyl-N-phenylbenzamide
CID 17230188
N-methyl-N-phenyl-4-propylbenzamide
CID 47719630
N-[4-[2-(diethylamino)ethoxy]phenyl]-4-methoxy-N-methylbenzamide
CID 70967812
N-(1-aminopropan-2-yl)-N-methyl-4-(phenoxymethyl)benzamide
CID 119582860

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide?
The IUPAC name of 4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide (CID 122195803) is 4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide.
What is the SMILES notation for 4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide?
The canonical SMILES for 4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide is COc1ccc(OCc2ccc(C(=O)N(C)c3ccccc3)cc2)cc1.
What is the InChIKey of 4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide?
The InChIKey is FAFDEROQJUNETC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO3/c1-23(19-6-4-3-5-7-19)22(24)18-10-8-17(9-11-18)16-26-21-14-12-20(25-2)13-15-21/h3-15H,16H2,1-2H3.
What are the key properties of 4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide?
4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide has a molecular weight of 347.41 g/mol, XLogP of 4.55, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methoxyphenoxy)methyl]-N-methyl-N-phenylbenzamide is sourced from PubChem (CID 122195803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).