N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide

C20H24N2O4 — CID 125144909

IUPACN-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide
SMILESCOc1cccc(CNC(=O)C(=O)NCc2ccccc2OC(C)C)c1
InChIInChI=1S/C20H24N2O4/c1-14(2)26-18-10-5-4-8-16(18)13-22-20(24)19(23)21-12-15-7-6-9-17(11-15)25-3/h4-11,14H,12-13H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyITOPYIHHFPPAAD-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.41
Rot. Bonds7

About N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide

N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide (PubChem CID 125144909) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide
PubChem CID125144909
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide
SMILESCOc1cccc(CNC(=O)C(=O)NCc2ccccc2OC(C)C)c1
InChIInChI=1S/C20H24N2O4/c1-14(2)26-18-10-5-4-8-16(18)13-22-20(24)19(23)21-12-15-7-6-9-17(11-15)25-3/h4-11,14H,12-13H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyITOPYIHHFPPAAD-UHFFFAOYSA-N
XLogP2.41
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-[(4-fluorophenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide
CID 124505025
N-[(3-methoxyphenyl)methyl]-N'-(2-methylpropyl)oxamide
CID 44902382
N-methyl-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide
CID 125144882
N'-[(3-methoxyphenyl)methyl]-N-methyloxamide
CID 2206408
N'-[(3-methoxyphenyl)methyl]oxamide
CID 69052749
1-[(2-methoxyphenyl)methyl]-3-[(3-methoxyphenyl)methyl]-2-methylguanidine;hydroiodide
CID 111216424
N-[(3-methoxyphenyl)methyl]-2-naphthalen-1-ylacetamide
CID 2086540
1-[(2-chlorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]urea
CID 38157251
N-[(3-methoxyphenyl)methyl]-2-naphthalen-2-yloxypropanamide
CID 53282955
(2R)-2-amino-N-[(3-methoxyphenyl)methyl]-3-methylbutanamide
CID 79013389
N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
CID 115598846
3-methoxy-N-[(3-propan-2-yloxyphenyl)methyl]naphthalene-2-carboxamide
CID 43910398

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide (CID 125144909) is N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide is COc1cccc(CNC(=O)C(=O)NCc2ccccc2OC(C)C)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide?
The InChIKey is ITOPYIHHFPPAAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-14(2)26-18-10-5-4-8-16(18)13-22-20(24)19(23)21-12-15-7-6-9-17(11-15)25-3/h4-11,14H,12-13H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide?
N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide has a molecular weight of 356.42 g/mol, XLogP of 2.41, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide is sourced from PubChem (CID 125144909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).