2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide

C22H26N2O3 — CID 46160677

IUPAC2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide
SMILESCOCC(=O)N(Cc1ccccc1)c1ccc(CC(=O)NCC2CC2)cc1
InChIInChI=1S/C22H26N2O3/c1-27-16-22(26)24(15-19-5-3-2-4-6-19)20-11-9-17(10-12-20)13-21(25)23-14-18-7-8-18/h2-6,9-12,18H,7-8,13-16H2,1H3,(H,23,25)
InChIKeySUKOZRHKIYOAJW-UHFFFAOYSA-N
MW366.46 g/mol
LogP2.93
Rot. Bonds9

About 2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide

2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide (PubChem CID 46160677) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is 2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide.

Molecular Properties

Compound Name2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide
PubChem CID46160677
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC Name2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide
SMILESCOCC(=O)N(Cc1ccccc1)c1ccc(CC(=O)NCC2CC2)cc1
InChIInChI=1S/C22H26N2O3/c1-27-16-22(26)24(15-19-5-3-2-4-6-19)20-11-9-17(10-12-20)13-21(25)23-14-18-7-8-18/h2-6,9-12,18H,7-8,13-16H2,1H3,(H,23,25)
InChIKeySUKOZRHKIYOAJW-UHFFFAOYSA-N
XLogP2.93
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(oxolan-2-ylmethyl)acetamide
CID 42852868
2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(2-phenylethyl)acetamide
CID 42852806
N-benzyl-N-[4-[2-(cyclopropylmethylamino)-2-oxoethyl]phenyl]-3-methoxybenzamide
CID 46052545
N-[4-[2-(cyclopropylmethylamino)-2-oxoethyl]phenyl]-N-[(4-methylphenyl)methyl]benzamide
CID 46052438
N-[4-[2-(cyclopropylmethylamino)-2-oxoethyl]phenyl]-N-[(4-methylphenyl)methyl]furan-2-carboxamide
CID 46052424
N-[4-[2-(cyclopropylmethylamino)-2-oxoethyl]phenyl]-N-[(4-methylphenyl)methyl]cyclopropanecarboxamide
CID 46052446
N-[(4-chlorocyclohexyl)methyl]-2-phenylacetamide
CID 114147876
2-[4-[(2-methoxyacetyl)-[(3-methylphenyl)methyl]amino]phenyl]-N-[(3-methylphenyl)methyl]acetamide
CID 46046632
2-[3-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(2-methoxyethyl)acetamide
CID 46056595
2-[4-[benzyl-(2-phenoxyacetyl)amino]phenyl]-N-(2-phenylethyl)acetamide
CID 46046116
N-[(4-bromocyclohexyl)methyl]-2-phenylacetamide
CID 106134234
ethyl 1-[2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]acetyl]piperidine-3-carboxylate
CID 42852925

Frequently Asked Questions

What is the IUPAC name of 2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide?
The IUPAC name of 2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide (CID 46160677) is 2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide.
What is the SMILES notation for 2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide?
The canonical SMILES for 2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide is COCC(=O)N(Cc1ccccc1)c1ccc(CC(=O)NCC2CC2)cc1.
What is the InChIKey of 2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide?
The InChIKey is SUKOZRHKIYOAJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-27-16-22(26)24(15-19-5-3-2-4-6-19)20-11-9-17(10-12-20)13-21(25)23-14-18-7-8-18/h2-6,9-12,18H,7-8,13-16H2,1H3,(H,23,25).
What are the key properties of 2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide?
2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide has a molecular weight of 366.46 g/mol, XLogP of 2.93, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[benzyl-(2-methoxyacetyl)amino]phenyl]-N-(cyclopropylmethyl)acetamide is sourced from PubChem (CID 46160677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).