N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide

C19H24N2O5S — CID 55639184

IUPACN-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide
SMILESCOc1cc(NC(=O)COc2cccc(C(C)C)c2)ccc1NS(C)(=O)=O
InChIInChI=1S/C19H24N2O5S/c1-13(2)14-6-5-7-16(10-14)26-12-19(22)20-15-8-9-17(18(11-15)25-3)21-27(4,23)24/h5-11,13,21H,12H2,1-4H3,(H,20,22)
InChIKeyUXZJYSVPNHMQEF-UHFFFAOYSA-N
MW392.48 g/mol
LogP3.21
Rot. Bonds8

About N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide

N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide (PubChem CID 55639184) has the molecular formula C19H24N2O5S and a molecular weight of 392.48 g/mol. Its IUPAC name is N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide.

Molecular Properties

Compound NameN-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide
PubChem CID55639184
Molecular FormulaC19H24N2O5S
Molecular Weight392.48 g/mol
Exact Mass392.14
IUPAC NameN-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide
SMILESCOc1cc(NC(=O)COc2cccc(C(C)C)c2)ccc1NS(C)(=O)=O
InChIInChI=1S/C19H24N2O5S/c1-13(2)14-6-5-7-16(10-14)26-12-19(22)20-15-8-9-17(18(11-15)25-3)21-27(4,23)24/h5-11,13,21H,12H2,1-4H3,(H,20,22)
InChIKeyUXZJYSVPNHMQEF-UHFFFAOYSA-N
XLogP3.21
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-iodophenyl)-2-(3-propan-2-ylphenoxy)acetamide
CID 19176026
2-(3-aminophenoxy)-N-(3-propan-2-ylphenyl)acetamide
CID 61035869
N-(3-acetylphenyl)-2-(3-propan-2-ylphenoxy)acetamide
CID 19175983
2-[3-(1-hydroxyethyl)phenoxy]-N-(4-propan-2-ylphenyl)acetamide
CID 110884631
N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide
CID 108745039
N-(3,4-dimethoxyphenyl)-2-(3-fluorophenoxy)acetamide
CID 2711600
N-(5-amino-2-methylphenyl)-2-(3-propan-2-ylphenoxy)acetamide
CID 16782919
2-[3-methyl-4-[[2-(3-propan-2-ylphenoxy)acetyl]amino]phenoxy]acetic acid
CID 119231617
N-[3-methoxy-4-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxypropanamide
CID 2972138
2-(3-tert-butylphenoxy)-N-(3,4-dimethoxyphenyl)acetamide
CID 112977639
2-(3-propan-2-ylphenoxy)-N-propylacetamide
CID 60624182
N-(3-fluoro-4-methylphenyl)-2-[3-(1-hydroxyethyl)phenoxy]acetamide
CID 110884614

Frequently Asked Questions

What is the IUPAC name of N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide?
The IUPAC name of N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide (CID 55639184) is N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide.
What is the SMILES notation for N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide?
The canonical SMILES for N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide is COc1cc(NC(=O)COc2cccc(C(C)C)c2)ccc1NS(C)(=O)=O.
What is the InChIKey of N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide?
The InChIKey is UXZJYSVPNHMQEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5S/c1-13(2)14-6-5-7-16(10-14)26-12-19(22)20-15-8-9-17(18(11-15)25-3)21-27(4,23)24/h5-11,13,21H,12H2,1-4H3,(H,20,22).
What are the key properties of N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide?
N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide has a molecular weight of 392.48 g/mol, XLogP of 3.21, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methanesulfonamido)-3-methoxyphenyl]-2-(3-propan-2-ylphenoxy)acetamide is sourced from PubChem (CID 55639184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).