2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide

C19H22FNO2 — CID 134045512

IUPAC2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide
SMILESCC(C)Oc1ccc(C(C)NC(=O)Cc2cccc(F)c2)cc1
InChIInChI=1S/C19H22FNO2/c1-13(2)23-18-9-7-16(8-10-18)14(3)21-19(22)12-15-5-4-6-17(20)11-15/h4-11,13-14H,12H2,1-3H3,(H,21,22)
InChIKeyLVMJGMIOPKCFJD-UHFFFAOYSA-N
MW315.39 g/mol
LogP4.03
Rot. Bonds6

About 2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide

2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide (PubChem CID 134045512) has the molecular formula C19H22FNO2 and a molecular weight of 315.39 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide
PubChem CID134045512
Molecular FormulaC19H22FNO2
Molecular Weight315.39 g/mol
Exact Mass315.16
IUPAC Name2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide
SMILESCC(C)Oc1ccc(C(C)NC(=O)Cc2cccc(F)c2)cc1
InChIInChI=1S/C19H22FNO2/c1-13(2)23-18-9-7-16(8-10-18)14(3)21-19(22)12-15-5-4-6-17(20)11-15/h4-11,13-14H,12H2,1-3H3,(H,21,22)
InChIKeyLVMJGMIOPKCFJD-UHFFFAOYSA-N
XLogP4.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.39
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(3-fluorophenyl)acetamide
CID 42961600
N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-2-(3-fluorophenyl)acetamide
CID 9437325
N-[1-(3-chlorophenyl)ethyl]-2-(3-fluorophenyl)acetamide
CID 42905870
2-(4-methoxyphenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide
CID 134060669
2-(3-bromophenyl)-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 133189879
2-(3-chlorophenyl)-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 133202355
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-phenylacetamide
CID 2713141
2-[(3-fluorophenyl)methylamino]-1-(4-propan-2-yloxyphenyl)ethanol
CID 111422221
3-amino-N-[1-(4-propan-2-yloxyphenyl)ethyl]propanamide;hydrochloride
CID 119285649
N-[2-[[N-ethyl-N'-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]carbamimidoyl]amino]ethyl]-2-(3-fluorophenyl)acetamide
CID 109493733
2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide
CID 62727102
2-(3-fluorophenyl)-N-(1-hydroxypropan-2-yl)acetamide
CID 43419046

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide (CID 134045512) is 2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide is CC(C)Oc1ccc(C(C)NC(=O)Cc2cccc(F)c2)cc1.
What is the InChIKey of 2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide?
The InChIKey is LVMJGMIOPKCFJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FNO2/c1-13(2)23-18-9-7-16(8-10-18)14(3)21-19(22)12-15-5-4-6-17(20)11-15/h4-11,13-14H,12H2,1-3H3,(H,21,22).
What are the key properties of 2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide?
2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide has a molecular weight of 315.39 g/mol, XLogP of 4.03, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide is sourced from PubChem (CID 134045512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).