N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide

C18H20F2N2O2 — CID 119748317

IUPACN-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide
SMILESCOCCNCC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C18H20F2N2O2/c1-24-11-10-21-12-17(23)22-18(13-2-6-15(19)7-3-13)14-4-8-16(20)9-5-14/h2-9,18,21H,10-12H2,1H3,(H,22,23)
InChIKeyDYPRKZJMRQMIFL-UHFFFAOYSA-N
MW334.37 g/mol
LogP2.41
Rot. Bonds8

About N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide

N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide (PubChem CID 119748317) has the molecular formula C18H20F2N2O2 and a molecular weight of 334.37 g/mol. Its IUPAC name is N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide.

Molecular Properties

Compound NameN-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide
PubChem CID119748317
Molecular FormulaC18H20F2N2O2
Molecular Weight334.37 g/mol
Exact Mass334.15
IUPAC NameN-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide
SMILESCOCCNCC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C18H20F2N2O2/c1-24-11-10-21-12-17(23)22-18(13-2-6-15(19)7-3-13)14-4-8-16(20)9-5-14/h2-9,18,21H,10-12H2,1H3,(H,22,23)
InChIKeyDYPRKZJMRQMIFL-UHFFFAOYSA-N
XLogP2.41
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.37
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide
CID 78908414
N-(2-chloro-5-fluorophenyl)-2-(2-methoxyethylamino)acetamide
CID 103808635
2-(2-methoxyethylamino)-N-[phenyl(pyridin-3-yl)methyl]acetamide
CID 119875696
N-[(4-fluorophenyl)-phenylmethyl]-2-methoxyacetamide
CID 47161833
2-(2-methoxyethylamino)-N-[phenyl(thiophen-2-yl)methyl]acetamide
CID 78912542
N-[1-(3,4-dichlorophenyl)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119686021
2-(2-methoxyethylamino)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 81364417
1-(2-chloro-5-fluorophenyl)-2-(2-methoxyethylamino)ethanone
CID 105396519
N-[(4-bromo-2-fluorophenyl)-phenylmethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119738549
N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119737229
N-[(5-fluoro-2-methoxyphenyl)-(3-methoxyphenyl)methyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119809465
2-(cyclopropylmethylamino)-N-[(4-fluorophenyl)-phenylmethyl]acetamide
CID 119716453

Frequently Asked Questions

What is the IUPAC name of N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide?
The IUPAC name of N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide (CID 119748317) is N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide.
What is the SMILES notation for N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide?
The canonical SMILES for N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide is COCCNCC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1.
What is the InChIKey of N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide?
The InChIKey is DYPRKZJMRQMIFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20F2N2O2/c1-24-11-10-21-12-17(23)22-18(13-2-6-15(19)7-3-13)14-4-8-16(20)9-5-14/h2-9,18,21H,10-12H2,1H3,(H,22,23).
What are the key properties of N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide?
N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide has a molecular weight of 334.37 g/mol, XLogP of 2.41, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[bis(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide is sourced from PubChem (CID 119748317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).