2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide

C19H23N3O4 — CID 55697500

IUPAC2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide
SMILESCOCC(=O)Nc1ccc(NC(=O)NCc2ccc(COC)cc2)cc1
InChIInChI=1S/C19H23N3O4/c1-25-12-15-5-3-14(4-6-15)11-20-19(24)22-17-9-7-16(8-10-17)21-18(23)13-26-2/h3-10H,11-13H2,1-2H3,(H,21,23)(H2,20,22,24)
InChIKeyNIMHZSUJQBLHSO-UHFFFAOYSA-N
MW357.41 g/mol
LogP2.74
Rot. Bonds8

About 2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide

2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide (PubChem CID 55697500) has the molecular formula C19H23N3O4 and a molecular weight of 357.41 g/mol. Its IUPAC name is 2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide
PubChem CID55697500
Molecular FormulaC19H23N3O4
Molecular Weight357.41 g/mol
Exact Mass357.17
IUPAC Name2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide
SMILESCOCC(=O)Nc1ccc(NC(=O)NCc2ccc(COC)cc2)cc1
InChIInChI=1S/C19H23N3O4/c1-25-12-15-5-3-14(4-6-15)11-20-19(24)22-17-9-7-16(8-10-17)21-18(23)13-26-2/h3-10H,11-13H2,1-2H3,(H,21,23)(H2,20,22,24)
InChIKeyNIMHZSUJQBLHSO-UHFFFAOYSA-N
XLogP2.74
TPSA88.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 52.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide
CID 43717389
N-[(4-acetamidophenyl)methyl]-2-methoxyacetamide
CID 29327648
N-[4-(hydroxymethyl)phenyl]-2-methoxyacetamide
CID 64794296
1-(3-fluoro-4-methoxyphenyl)-3-[[4-(methoxymethyl)phenyl]methyl]urea
CID 51082657
N-[4-[(2,4-dichlorophenyl)methylcarbamoylamino]phenyl]-2-methoxyacetamide
CID 55697658
1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(methoxymethyl)phenyl]urea
CID 119049625
N-[[4-(methoxymethyl)phenyl]methyl]-2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]acetamide
CID 87012824
2-[[2-[4-[(2-methoxyacetyl)amino]phenyl]acetyl]amino]acetic acid
CID 119224391
ethyl [4-[[4-[(2-methoxyacetyl)amino]phenyl]methylcarbamoyl]phenyl] carbonate
CID 108931327
2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 43708154
N-(4-hydrazinylphenyl)-2-methoxyacetamide
CID 141361616
methyl 4-[(4-methylphenyl)methylcarbamoylamino]benzoate
CID 108899109

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide?
The IUPAC name of 2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide (CID 55697500) is 2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide?
The canonical SMILES for 2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide is COCC(=O)Nc1ccc(NC(=O)NCc2ccc(COC)cc2)cc1.
What is the InChIKey of 2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide?
The InChIKey is NIMHZSUJQBLHSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4/c1-25-12-15-5-3-14(4-6-15)11-20-19(24)22-17-9-7-16(8-10-17)21-18(23)13-26-2/h3-10H,11-13H2,1-2H3,(H,21,23)(H2,20,22,24).
What are the key properties of 2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide?
2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide has a molecular weight of 357.41 g/mol, XLogP of 2.74, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide is sourced from PubChem (CID 55697500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).