N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide

C19H21F2NO4 — CID 60566958

IUPACN-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide
SMILESCOCCOc1ccccc1C(=O)NC(C)c1ccc(OC(F)F)cc1
InChIInChI=1S/C19H21F2NO4/c1-13(14-7-9-15(10-8-14)26-19(20)21)22-18(23)16-5-3-4-6-17(16)25-12-11-24-2/h3-10,13,19H,11-12H2,1-2H3,(H,22,23)
InChIKeyCJCSKZHNGGTUNJ-UHFFFAOYSA-N
MW365.38 g/mol
LogP3.80
Rot. Bonds9

About N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide

N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide (PubChem CID 60566958) has the molecular formula C19H21F2NO4 and a molecular weight of 365.38 g/mol. Its IUPAC name is N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide.

Molecular Properties

Compound NameN-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide
PubChem CID60566958
Molecular FormulaC19H21F2NO4
Molecular Weight365.38 g/mol
Exact Mass365.14
IUPAC NameN-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide
SMILESCOCCOc1ccccc1C(=O)NC(C)c1ccc(OC(F)F)cc1
InChIInChI=1S/C19H21F2NO4/c1-13(14-7-9-15(10-8-14)26-19(20)21)22-18(23)16-5-3-4-6-17(16)25-12-11-24-2/h3-10,13,19H,11-12H2,1-2H3,(H,22,23)
InChIKeyCJCSKZHNGGTUNJ-UHFFFAOYSA-N
XLogP3.80
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.38
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-[2-(dimethylamino)ethoxy]benzamide
CID 55959876
1-[1-[4-(difluoromethoxy)phenyl]ethyl]-3-[3-(2-methoxyethoxy)phenyl]urea
CID 87010141
2-(difluoromethoxy)-3-methoxy-N-(1-phenylethyl)benzamide
CID 51147641
N-[(1S)-1-(4-ethoxyphenyl)ethyl]-2-phenylmethoxybenzamide
CID 99953141
2-(2-amino-2-oxoethoxy)-N-[1-(4-ethoxyphenyl)ethyl]benzamide
CID 24582222
2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide
CID 43876733
2-[(2-butoxybenzoyl)amino]-N-[(1R)-1-phenylethyl]benzamide
CID 8766894
tert-butyl N-[2-[2-[[(1R)-1-[4-(difluoromethoxy)phenyl]ethyl]carbamoyl]phenyl]ethyl]carbamate
CID 167780378
N-[(1R)-1-phenylethyl]-2-propan-2-yloxybenzamide
CID 92666015
2-(difluoromethoxy)-N-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]benzamide
CID 7964326
2-(difluoromethoxy)-N-[2-oxo-2-(1-phenylethylamino)ethyl]benzamide
CID 78583452
2-bromo-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 962592

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide?
The IUPAC name of N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide (CID 60566958) is N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide.
What is the SMILES notation for N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide?
The canonical SMILES for N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide is COCCOc1ccccc1C(=O)NC(C)c1ccc(OC(F)F)cc1.
What is the InChIKey of N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide?
The InChIKey is CJCSKZHNGGTUNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F2NO4/c1-13(14-7-9-15(10-8-14)26-19(20)21)22-18(23)16-5-3-4-6-17(16)25-12-11-24-2/h3-10,13,19H,11-12H2,1-2H3,(H,22,23).
What are the key properties of N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide?
N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide has a molecular weight of 365.38 g/mol, XLogP of 3.80, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-(difluoromethoxy)phenyl]ethyl]-2-(2-methoxyethoxy)benzamide is sourced from PubChem (CID 60566958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).