2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide

C18H20F2N2O2 — CID 120667280

IUPAC2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)NC(C)c2cccc(OC(F)F)c2)cc1
InChIInChI=1S/C18H20F2N2O2/c1-11-6-8-13(9-7-11)16(21)17(23)22-12(2)14-4-3-5-15(10-14)24-18(19)20/h3-10,12,16,18H,21H2,1-2H3,(H,22,23)
InChIKeyLDLONVYAJIEYJS-UHFFFAOYSA-N
MW334.37 g/mol
LogP3.47
Rot. Bonds6

About 2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide

2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide (PubChem CID 120667280) has the molecular formula C18H20F2N2O2 and a molecular weight of 334.37 g/mol. Its IUPAC name is 2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide
PubChem CID120667280
Molecular FormulaC18H20F2N2O2
Molecular Weight334.37 g/mol
Exact Mass334.15
IUPAC Name2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)NC(C)c2cccc(OC(F)F)c2)cc1
InChIInChI=1S/C18H20F2N2O2/c1-11-6-8-13(9-7-11)16(21)17(23)22-12(2)14-4-3-5-15(10-14)24-18(19)20/h3-10,12,16,18H,21H2,1-2H3,(H,22,23)
InChIKeyLDLONVYAJIEYJS-UHFFFAOYSA-N
XLogP3.47
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.37
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide
CID 81357033
(2R)-2-amino-N-[(1R)-1-(3-methoxyphenyl)ethyl]-2-phenylacetamide
CID 81354308
(2S)-2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]pentanamide
CID 107568388
2-amino-2-(4-methylphenyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride
CID 120666705
2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-3-methoxypropanamide
CID 81083665
N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2,5-dimethylbenzamide
CID 42961731
2-(aminomethyl)-N-[1-[3-(difluoromethoxy)phenyl]ethyl]butanamide
CID 65225924
(2R)-2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-4-methylsulfanylbutanamide
CID 104907136
2-amino-N-[1-(3,4-dimethoxyphenyl)ethyl]-2-(4-methylphenyl)acetamide
CID 120667278
(2R)-2-amino-N-[1-(3-propan-2-yloxyphenyl)ethyl]propanamide
CID 54995688
2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride
CID 119320621
N-[1-[3-(difluoromethoxy)phenyl]ethyl]but-3-yn-2-amine
CID 114415071

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of 2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide (CID 120667280) is 2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for 2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide is Cc1ccc(C(N)C(=O)NC(C)c2cccc(OC(F)F)c2)cc1.
What is the InChIKey of 2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide?
The InChIKey is LDLONVYAJIEYJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20F2N2O2/c1-11-6-8-13(9-7-11)16(21)17(23)22-12(2)14-4-3-5-15(10-14)24-18(19)20/h3-10,12,16,18H,21H2,1-2H3,(H,22,23).
What are the key properties of 2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide?
2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide has a molecular weight of 334.37 g/mol, XLogP of 3.47, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 120667280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).