2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide

C16H15ClFNO2 — CID 53265982

IUPAC2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide
SMILESCc1cc(OC(C)C(=O)Nc2cccc(F)c2)ccc1Cl
InChIInChI=1S/C16H15ClFNO2/c1-10-8-14(6-7-15(10)17)21-11(2)16(20)19-13-5-3-4-12(18)9-13/h3-9,11H,1-2H3,(H,19,20)
InChIKeyBWHOBDZRVOMFDS-UHFFFAOYSA-N
MW307.75 g/mol
LogP4.19
Rot. Bonds4

About 2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide

2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide (PubChem CID 53265982) has the molecular formula C16H15ClFNO2 and a molecular weight of 307.75 g/mol. Its IUPAC name is 2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide.

Molecular Properties

Compound Name2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide
PubChem CID53265982
Molecular FormulaC16H15ClFNO2
Molecular Weight307.75 g/mol
Exact Mass307.08
IUPAC Name2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide
SMILESCc1cc(OC(C)C(=O)Nc2cccc(F)c2)ccc1Cl
InChIInChI=1S/C16H15ClFNO2/c1-10-8-14(6-7-15(10)17)21-11(2)16(20)19-13-5-3-4-12(18)9-13/h3-9,11H,1-2H3,(H,19,20)
InChIKeyBWHOBDZRVOMFDS-UHFFFAOYSA-N
XLogP4.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.75
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide
CID 132652829
2-(4-chlorophenoxy)-N-(3-fluorophenyl)propanamide
CID 21173814
N-(3-fluorophenyl)-2-(4-methylphenoxy)propanamide
CID 18076804
3-[2-(4-chloro-3-methylphenoxy)propanoylamino]benzamide
CID 53288806
2-(4-chloro-3-methylphenoxy)-N-(3,4-dichlorophenyl)propanamide
CID 53265973
(2S)-N-(3-fluorophenyl)-2-(3-methyl-4-nitrophenoxy)propanamide
CID 9384222
(2R)-2-(4-chloro-3-methylphenoxy)-N-(2,6-dimethylphenyl)propanamide
CID 26542487
2-(4-chloro-3-methylphenoxy)-N-(4-iodophenyl)propanamide
CID 53265997
methyl N-[3-[2-(3-fluorophenoxy)propanoylamino]phenyl]carbamate
CID 87025785
N-(3-bromophenyl)-2-(3-fluorophenoxy)propanamide
CID 47119298
(2S)-2-(4-chloro-3-methylphenoxy)-N-(3,4-dimethoxyphenyl)propanamide
CID 26802583
(2S)-N-(3-chloro-4-methylphenyl)-2-(4-fluorophenoxy)propanamide
CID 7734043

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide?
The IUPAC name of 2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide (CID 53265982) is 2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide.
What is the SMILES notation for 2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide?
The canonical SMILES for 2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide is Cc1cc(OC(C)C(=O)Nc2cccc(F)c2)ccc1Cl.
What is the InChIKey of 2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide?
The InChIKey is BWHOBDZRVOMFDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFNO2/c1-10-8-14(6-7-15(10)17)21-11(2)16(20)19-13-5-3-4-12(18)9-13/h3-9,11H,1-2H3,(H,19,20).
What are the key properties of 2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide?
2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide has a molecular weight of 307.75 g/mol, XLogP of 4.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide is sourced from PubChem (CID 53265982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).