N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide

C19H22FNO2 — CID 17068382

IUPACN-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide
SMILESCC(Oc1ccccc1C(C)C)C(=O)NCc1ccccc1F
InChIInChI=1S/C19H22FNO2/c1-13(2)16-9-5-7-11-18(16)23-14(3)19(22)21-12-15-8-4-6-10-17(15)20/h4-11,13-14H,12H2,1-3H3,(H,21,22)
InChIKeyOVBSLVSWBAFCMF-UHFFFAOYSA-N
MW315.39 g/mol
LogP4.03
Rot. Bonds6

About N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide

N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide (PubChem CID 17068382) has the molecular formula C19H22FNO2 and a molecular weight of 315.39 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide
PubChem CID17068382
Molecular FormulaC19H22FNO2
Molecular Weight315.39 g/mol
Exact Mass315.16
IUPAC NameN-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide
SMILESCC(Oc1ccccc1C(C)C)C(=O)NCc1ccccc1F
InChIInChI=1S/C19H22FNO2/c1-13(2)16-9-5-7-11-18(16)23-14(3)19(22)21-12-15-8-4-6-10-17(15)20/h4-11,13-14H,12H2,1-3H3,(H,21,22)
InChIKeyOVBSLVSWBAFCMF-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

(2R)-N-ethyl-2-(2-propan-2-ylphenoxy)propanamide
CID 92685149
2-(2-propan-2-ylphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 43876908
(2R)-2-(2,4-dichlorophenoxy)-N-[(2-fluorophenyl)methyl]propanamide
CID 8870855
N-[(2-fluorophenyl)methyl]-2-(4-hydroxyphenoxy)propanamide
CID 56983513
(2S)-N-[(4-ethoxyphenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide
CID 94018489
N-[2-(4-fluorophenoxy)ethyl]-2-(2-propan-2-ylphenoxy)propanamide
CID 133239810
(2S)-N-[2-(dimethylamino)ethyl]-2-(2-propan-2-ylphenoxy)propanamide
CID 30379413
(2S)-2-(4-tert-butylphenoxy)-N-[(2-fluorophenyl)methyl]propanamide
CID 8571270
(2R)-N-[(3-propan-2-yloxyphenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide
CID 92683578
N-(3-propan-2-yloxypropyl)-2-(2-propan-2-ylphenoxy)propanamide
CID 43877163
2-(2-fluorophenoxy)-N-(1H-pyrrol-3-ylmethyl)propanamide
CID 106385142
N-[(2-ethoxyphenyl)methyl]-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 133201955

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide?
The IUPAC name of N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide (CID 17068382) is N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide is CC(Oc1ccccc1C(C)C)C(=O)NCc1ccccc1F.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide?
The InChIKey is OVBSLVSWBAFCMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FNO2/c1-13(2)16-9-5-7-11-18(16)23-14(3)19(22)21-12-15-8-4-6-10-17(15)20/h4-11,13-14H,12H2,1-3H3,(H,21,22).
What are the key properties of N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide?
N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide 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 N-[(2-fluorophenyl)methyl]-2-(2-propan-2-ylphenoxy)propanamide is sourced from PubChem (CID 17068382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).