N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide

C18H20N2O3 — CID 38300689

IUPACN-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide
SMILESCCC(=O)Nc1cccc(NC(=O)COc2ccccc2)c1C
InChIInChI=1S/C18H20N2O3/c1-3-17(21)19-15-10-7-11-16(13(15)2)20-18(22)12-23-14-8-5-4-6-9-14/h4-11H,3,12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyFPMBUFQKHZPFAA-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.36
Rot. Bonds6

About N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide

N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide (PubChem CID 38300689) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide.

Molecular Properties

Compound NameN-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide
PubChem CID38300689
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide
SMILESCCC(=O)Nc1cccc(NC(=O)COc2ccccc2)c1C
InChIInChI=1S/C18H20N2O3/c1-3-17(21)19-15-10-7-11-16(13(15)2)20-18(22)12-23-14-8-5-4-6-9-14/h4-11H,3,12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyFPMBUFQKHZPFAA-UHFFFAOYSA-N
XLogP3.36
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]-2-methylphenyl]propanamide
CID 38300469
N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide
CID 134019141
N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide
CID 115949978
N-[3-[[2-(4-chlorophenoxy)acetyl]amino]-2-methylphenyl]benzamide
CID 55899034
N'-(2-phenoxyacetyl)propanehydrazide
CID 4508940
N-[2-methyl-3-(propanoylamino)phenyl]benzamide
CID 38300041
N-[[2-methyl-3-(propanoylamino)phenyl]carbamothioyl]-4-(2-phenoxyethoxy)benzamide
CID 46760871
N-(3-acetamido-2-methylphenyl)-2-(4-cyanophenoxy)acetamide
CID 134019347
N-[3-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-2-methylphenyl]propanamide
CID 38300862
N-[2-methyl-3-(propanoylamino)phenyl]-3-phenylmethoxybenzamide
CID 38300494
N-[2-methyl-3-(propanoylamino)phenyl]-3-phenylpropanamide
CID 38300101
2-phenoxy-N-(2-propan-2-ylphenyl)acetamide
CID 723304

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide?
The IUPAC name of N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide (CID 38300689) is N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide.
What is the SMILES notation for N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide?
The canonical SMILES for N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide is CCC(=O)Nc1cccc(NC(=O)COc2ccccc2)c1C.
What is the InChIKey of N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide?
The InChIKey is FPMBUFQKHZPFAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-3-17(21)19-15-10-7-11-16(13(15)2)20-18(22)12-23-14-8-5-4-6-9-14/h4-11H,3,12H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide?
N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide has a molecular weight of 312.37 g/mol, XLogP of 3.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide is sourced from PubChem (CID 38300689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).