N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide

C23H23NO2 — CID 8919009

IUPACN-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)N(C)C(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C23H23NO2/c1-18-10-9-15-21(16-18)26-17-22(25)24(2)23(19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-16,23H,17H2,1-2H3
InChIKeyKTCZANPJNXZPRU-UHFFFAOYSA-N
MW345.44 g/mol
LogP4.62
Rot. Bonds6

About N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide

N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide (PubChem CID 8919009) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide
PubChem CID8919009
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC NameN-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)N(C)C(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C23H23NO2/c1-18-10-9-15-21(16-18)26-17-22(25)24(2)23(19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-16,23H,17H2,1-2H3
InChIKeyKTCZANPJNXZPRU-UHFFFAOYSA-N
XLogP4.62
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-methylphenoxy)-N,N-di(propan-2-yl)acetamide
CID 892170
N-[1H-indol-3-yl-(4-methoxyphenyl)methyl]-N-methyl-2-(3-methylphenoxy)acetamide
CID 43843744
2-(3-methylphenoxy)-N-[(1R)-1-phenylethyl]acetamide
CID 879297
N-benzyl-2-(3-methylphenoxy)-N-phenylacetamide
CID 112977258
4-[methyl-[2-(3-methylphenoxy)acetyl]amino]butanoic acid
CID 43240315
2-[tert-butyl-[2-(3-methylphenoxy)acetyl]amino]acetic acid
CID 79266699
ethyl 2-[methyl-[2-(3-methylphenoxy)acetyl]amino]acetate
CID 54785206
2-[[2-(3-methylphenoxy)acetyl]amino]-2-phenylacetamide
CID 47017240
3-[[2-(3-methylphenoxy)acetyl]amino]-3-phenylpropanoic acid
CID 45461281
N-methyl-2-(3-methyl-4-propan-2-ylphenoxy)-N-[phenyl(pyridin-2-yl)methyl]acetamide
CID 55767815
N-[(2-chlorophenyl)methyl]-N-methyl-2-(3-methylphenoxy)acetamide
CID 112790388
3-amino-N-methyl-N-[2-(3-methylphenoxy)ethyl]-3-phenylpropanamide
CID 119949182

Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide?
The IUPAC name of N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide (CID 8919009) is N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide.
What is the SMILES notation for N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide?
The canonical SMILES for N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide is Cc1cccc(OCC(=O)N(C)C(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide?
The InChIKey is KTCZANPJNXZPRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO2/c1-18-10-9-15-21(16-18)26-17-22(25)24(2)23(19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-16,23H,17H2,1-2H3.
What are the key properties of N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide?
N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide has a molecular weight of 345.44 g/mol, XLogP of 4.62, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-N-methyl-2-(3-methylphenoxy)acetamide is sourced from PubChem (CID 8919009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).