2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide

C22H27NO2 — CID 110437831

IUPAC2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide
SMILESCOc1ccc(C(C)(C)C(=O)NCC2(c3ccccc3)CCC2)cc1
InChIInChI=1S/C22H27NO2/c1-21(2,17-10-12-19(25-3)13-11-17)20(24)23-16-22(14-7-15-22)18-8-5-4-6-9-18/h4-6,8-13H,7,14-16H2,1-3H3,(H,23,24)
InChIKeyZNAFMCKKDBZMIN-UHFFFAOYSA-N
MW337.46 g/mol
LogP4.21
Rot. Bonds6

About 2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide

2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide (PubChem CID 110437831) has the molecular formula C22H27NO2 and a molecular weight of 337.46 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide
PubChem CID110437831
Molecular FormulaC22H27NO2
Molecular Weight337.46 g/mol
Exact Mass337.20
IUPAC Name2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide
SMILESCOc1ccc(C(C)(C)C(=O)NCC2(c3ccccc3)CCC2)cc1
InChIInChI=1S/C22H27NO2/c1-21(2,17-10-12-19(25-3)13-11-17)20(24)23-16-22(14-7-15-22)18-8-5-4-6-9-18/h4-6,8-13H,7,14-16H2,1-3H3,(H,23,24)
InChIKeyZNAFMCKKDBZMIN-UHFFFAOYSA-N
XLogP4.21
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.46
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-methyl-N-[(1-phenylcyclopentyl)methyl]propanamide
CID 110480032
1-(2,4-dimethoxyphenyl)-3-[(1-phenylcyclobutyl)methyl]urea
CID 113214996
(E)-3-(4-methoxyphenyl)-N-[(1-phenylcyclopentyl)methyl]prop-2-enamide
CID 5399176
N-[[1-(4-methoxyphenyl)cyclobutyl]methyl]-2-methylpropanamide
CID 110478485
4-[[1-(4-methoxyphenyl)cyclobutyl]methylcarbamoylamino]butanoic acid
CID 122009757
N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-2,2-diphenylacetamide
CID 113090745
3-[[1-(4-methoxyphenyl)cyclobutyl]methylcarbamoyl-methylamino]propanoic acid
CID 122009760
N-[[4-(4-methoxyphenyl)-1-propan-2-ylpiperidin-4-yl]methyl]-2,2-dimethylpropanamide
CID 67986619
4-[4-[(1-phenylcyclobutyl)methylcarbamoyl]phenoxy]benzamide
CID 56546048
N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-4-(trifluoromethyl)benzamide
CID 42265583
N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110437825
2,2,2-trifluoro-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 110443182

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide?
The IUPAC name of 2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide (CID 110437831) is 2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide?
The canonical SMILES for 2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide is COc1ccc(C(C)(C)C(=O)NCC2(c3ccccc3)CCC2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide?
The InChIKey is ZNAFMCKKDBZMIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27NO2/c1-21(2,17-10-12-19(25-3)13-11-17)20(24)23-16-22(14-7-15-22)18-8-5-4-6-9-18/h4-6,8-13H,7,14-16H2,1-3H3,(H,23,24).
What are the key properties of 2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide?
2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide has a molecular weight of 337.46 g/mol, XLogP of 4.21, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-2-methyl-N-[(1-phenylcyclobutyl)methyl]propanamide is sourced from PubChem (CID 110437831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).