(2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide

C20H18FNO4 — CID 7564685

IUPAC(2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide
SMILESC[C@@H](Oc1ccc2ccc(=O)oc2c1)C(=O)NCCc1ccc(F)cc1
InChIInChI=1S/C20H18FNO4/c1-13(20(24)22-11-10-14-2-6-16(21)7-3-14)25-17-8-4-15-5-9-19(23)26-18(15)12-17/h2-9,12-13H,10-11H2,1H3,(H,22,24)/t13-/m1/s1
InChIKeyBZRYTQKMPGCUQP-CYBMUJFWSA-N
MW355.37 g/mol
LogP3.06
Rot. Bonds6

About (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide

(2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide (PubChem CID 7564685) has the molecular formula C20H18FNO4 and a molecular weight of 355.37 g/mol. Its IUPAC name is (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide.

Molecular Properties

Compound Name(2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide
PubChem CID7564685
Molecular FormulaC20H18FNO4
Molecular Weight355.37 g/mol
Exact Mass355.12
IUPAC Name(2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide
SMILESC[C@@H](Oc1ccc2ccc(=O)oc2c1)C(=O)NCCc1ccc(F)cc1
InChIInChI=1S/C20H18FNO4/c1-13(20(24)22-11-10-14-2-6-16(21)7-3-14)25-17-8-4-15-5-9-19(23)26-18(15)12-17/h2-9,12-13H,10-11H2,1H3,(H,22,24)/t13-/m1/s1
InChIKeyBZRYTQKMPGCUQP-CYBMUJFWSA-N
XLogP3.06
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.37
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide 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

(2S)-2-(4-bromophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 9391636
N-[2-(4-fluorophenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide
CID 112778014
(2S)-N-[2-(1H-indol-3-yl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide
CID 7094958
(2R)-N-[2-(1H-indol-3-yl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide
CID 7094961
(2S)-N-(4-ethylphenyl)-2-(2-oxochromen-7-yl)oxypropanamide
CID 7290663
4-[1-[2-(4-fluorophenyl)ethylamino]-1-oxopropan-2-yl]oxybenzamide
CID 112778533
2-(4-fluorophenoxy)-N-[3-(4-propan-2-yloxyphenyl)propyl]propanamide
CID 132654154
(2R)-N-carbamoyl-2-(2-oxochromen-7-yl)oxypropanamide
CID 7233690
2-(4-chloro-3,5-dimethylphenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 133164196
N-[2-(4-fluorophenyl)ethyl]-2-(3-iodophenoxy)propanamide
CID 112786440
(2S)-2-(2-oxochromen-7-yl)oxy-N-(2,3,4-trifluorophenyl)propanamide
CID 7290728
(2S)-2-(2-oxochromen-7-yl)oxy-N-phenylpropanamide
CID 7564455

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide?
The IUPAC name of (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide (CID 7564685) is (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide.
What is the SMILES notation for (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide?
The canonical SMILES for (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide is C[C@@H](Oc1ccc2ccc(=O)oc2c1)C(=O)NCCc1ccc(F)cc1.
What is the InChIKey of (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide?
The InChIKey is BZRYTQKMPGCUQP-CYBMUJFWSA-N. The full InChI is InChI=1S/C20H18FNO4/c1-13(20(24)22-11-10-14-2-6-16(21)7-3-14)25-17-8-4-15-5-9-19(23)26-18(15)12-17/h2-9,12-13H,10-11H2,1H3,(H,22,24)/t13-/m1/s1.
What are the key properties of (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide?
(2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide has a molecular weight of 355.37 g/mol, XLogP of 3.06, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(4-fluorophenyl)ethyl]-2-(2-oxochromen-7-yl)oxypropanamide is sourced from PubChem (CID 7564685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).