N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide

C20H22FNO3 — CID 134013750

IUPACN-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide
SMILESCCOc1ccc(OCC(=O)N(Cc2ccccc2F)C2CC2)cc1
InChIInChI=1S/C20H22FNO3/c1-2-24-17-9-11-18(12-10-17)25-14-20(23)22(16-7-8-16)13-15-5-3-4-6-19(15)21/h3-6,9-12,16H,2,7-8,13-14H2,1H3
InChIKeyHAPLFBOZWIRBSK-UHFFFAOYSA-N
MW343.40 g/mol
LogP3.79
Rot. Bonds8

About N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide

N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide (PubChem CID 134013750) has the molecular formula C20H22FNO3 and a molecular weight of 343.40 g/mol. Its IUPAC name is N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide
PubChem CID134013750
Molecular FormulaC20H22FNO3
Molecular Weight343.40 g/mol
Exact Mass343.16
IUPAC NameN-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide
SMILESCCOc1ccc(OCC(=O)N(Cc2ccccc2F)C2CC2)cc1
InChIInChI=1S/C20H22FNO3/c1-2-24-17-9-11-18(12-10-17)25-14-20(23)22(16-7-8-16)13-15-5-3-4-6-19(15)21/h3-6,9-12,16H,2,7-8,13-14H2,1H3
InChIKeyHAPLFBOZWIRBSK-UHFFFAOYSA-N
XLogP3.79
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.40
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxoethyl]-4-ethoxybenzamide
CID 31443397
2-(4-chloro-3-methylphenoxy)-N-cyclopropyl-N-[(2-fluorophenyl)methyl]acetamide
CID 55391124
N-[(2S)-1-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-3-methyl-1-oxobutan-2-yl]-4-ethoxybenzamide
CID 55943138
2-(4-chlorophenoxy)-N-[(3R)-1,1-dioxothiolan-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
CID 40643582
N-cyclopropyl-N-[(2-fluorophenyl)methyl]butanamide
CID 60666172
N-cyclopropyl-2-ethoxy-N-[(2-fluorophenyl)methyl]benzamide
CID 55391046
N-[(3R)-1,1-dioxothiolan-3-yl]-N-[(2-fluorophenyl)methyl]-2-(4-nitrophenoxy)acetamide
CID 27316931
2-[cyclopropyl-[2-(4-ethoxyphenoxy)acetyl]amino]acetic acid
CID 60826404
2-amino-N-cyclopropyl-N-[(2-fluorophenyl)methyl]acetamide;hydrochloride
CID 119272337
2-[2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxoethoxy]-N-phenylbenzamide
CID 9018501
[2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxoethyl] 2-hydroxy-4-methoxybenzoate
CID 9406115
N-[(3R)-1,1-dioxothiolan-3-yl]-N-[(2-fluorophenyl)methyl]-2-(2-methylphenoxy)acetamide
CID 40643590

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide?
The IUPAC name of N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide (CID 134013750) is N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide?
The canonical SMILES for N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide is CCOc1ccc(OCC(=O)N(Cc2ccccc2F)C2CC2)cc1.
What is the InChIKey of N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide?
The InChIKey is HAPLFBOZWIRBSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22FNO3/c1-2-24-17-9-11-18(12-10-17)25-14-20(23)22(16-7-8-16)13-15-5-3-4-6-19(15)21/h3-6,9-12,16H,2,7-8,13-14H2,1H3.
What are the key properties of N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide?
N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide has a molecular weight of 343.40 g/mol, XLogP of 3.79, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(4-ethoxyphenoxy)-N-[(2-fluorophenyl)methyl]acetamide is sourced from PubChem (CID 134013750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).