N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide

C22H26N2O4 — CID 50975306

IUPACN-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide
SMILESCCOc1cccc(CN(C(=O)c2cccc(NC(=O)COC)c2)C2CC2)c1
InChIInChI=1S/C22H26N2O4/c1-3-28-20-9-4-6-16(12-20)14-24(19-10-11-19)22(26)17-7-5-8-18(13-17)23-21(25)15-27-2/h4-9,12-13,19H,3,10-11,14-15H2,1-2H3,(H,23,25)
InChIKeyCFUCCGMICYMWQZ-UHFFFAOYSA-N
MW382.46 g/mol
LogP3.47
Rot. Bonds9

About N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide

N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide (PubChem CID 50975306) has the molecular formula C22H26N2O4 and a molecular weight of 382.46 g/mol. Its IUPAC name is N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide
PubChem CID50975306
Molecular FormulaC22H26N2O4
Molecular Weight382.46 g/mol
Exact Mass382.19
IUPAC NameN-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide
SMILESCCOc1cccc(CN(C(=O)c2cccc(NC(=O)COC)c2)C2CC2)c1
InChIInChI=1S/C22H26N2O4/c1-3-28-20-9-4-6-16(12-20)14-24(19-10-11-19)22(26)17-7-5-8-18(13-17)23-21(25)15-27-2/h4-9,12-13,19H,3,10-11,14-15H2,1-2H3,(H,23,25)
InChIKeyCFUCCGMICYMWQZ-UHFFFAOYSA-N
XLogP3.47
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopropyl-1-[(3-ethoxyphenyl)methyl]-3-(2-methylsulfanylethyl)urea
CID 119065491
N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-4-methylpyridine-3-carboxamide
CID 46998435
methyl 2-[3-[cyclopropyl-[(4-methylphenyl)methyl]carbamoyl]phenoxy]acetate
CID 55873499
N-cyclopropyl-3-[[2-(3-ethylphenoxy)acetyl]amino]benzamide
CID 26993706
N-cyclopropyl-N-[(4-ethoxyphenyl)methyl]-3-pyrazin-2-ylbenzamide
CID 118763811
N-[3-[cyclopropyl-[(4-methoxyphenyl)methyl]carbamoyl]phenyl]thiophene-2-carboxamide
CID 9299373
N-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl]-N-cyclohexyl-3-ethoxybenzamide
CID 22781242
1-cyclopropyl-1-[(3-ethoxyphenyl)methyl]-3-[[(3R)-1-ethylpyrrolidin-3-yl]methyl]urea
CID 126442915
[3-[[cyclopropyl-(2-methoxyacetyl)amino]methyl]phenyl] ethanesulfonate
CID 42811412
N-benzyl-N-methyl-3-[(2-phenoxyacetyl)amino]benzamide
CID 26162773
3-[[2-(3-ethoxyanilino)-2-oxoethyl]amino]-N,N-dimethylbenzamide
CID 54840596
2-ethoxy-N-(3-ethoxyphenyl)acetamide
CID 61062065

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide?
The IUPAC name of N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide (CID 50975306) is N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide.
What is the SMILES notation for N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide?
The canonical SMILES for N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide is CCOc1cccc(CN(C(=O)c2cccc(NC(=O)COC)c2)C2CC2)c1.
What is the InChIKey of N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide?
The InChIKey is CFUCCGMICYMWQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O4/c1-3-28-20-9-4-6-16(12-20)14-24(19-10-11-19)22(26)17-7-5-8-18(13-17)23-21(25)15-27-2/h4-9,12-13,19H,3,10-11,14-15H2,1-2H3,(H,23,25).
What are the key properties of N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide?
N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide has a molecular weight of 382.46 g/mol, XLogP of 3.47, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-3-[(2-methoxyacetyl)amino]benzamide is sourced from PubChem (CID 50975306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).