5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide

C23H27FN2O3 — CID 110306179

IUPAC5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide
SMILESO=C(CCCCc1ccc(F)cc1)N[C@H](C(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C23H27FN2O3/c24-20-12-10-18(11-13-20)6-4-5-9-21(27)25-22(19-7-2-1-3-8-19)23(28)26-14-16-29-17-15-26/h1-3,7-8,10-13,22H,4-6,9,14-17H2,(H,25,27)/t22-/m0/s1
InChIKeyCHYYQTDLNRNQLH-QFIPXVFZSA-N
MW398.48 g/mol
LogP3.25
Rot. Bonds8

About 5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide

5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide (PubChem CID 110306179) has the molecular formula C23H27FN2O3 and a molecular weight of 398.48 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide
PubChem CID110306179
Molecular FormulaC23H27FN2O3
Molecular Weight398.48 g/mol
Exact Mass398.20
IUPAC Name5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide
SMILESO=C(CCCCc1ccc(F)cc1)N[C@H](C(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C23H27FN2O3/c24-20-12-10-18(11-13-20)6-4-5-9-21(27)25-22(19-7-2-1-3-8-19)23(28)26-14-16-29-17-15-26/h1-3,7-8,10-13,22H,4-6,9,14-17H2,(H,25,27)/t22-/m0/s1
InChIKeyCHYYQTDLNRNQLH-QFIPXVFZSA-N
XLogP3.25
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.48
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide 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

4-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]-4-oxobutanamide
CID 110306181
N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]-2-phenylacetamide
CID 110286922
N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]-5-thiophen-2-ylpentanamide
CID 110306130
2-(3,4-dimethoxyphenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]acetamide
CID 110286938
N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]-2-naphthalen-1-ylacetamide
CID 51960254
3-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]-3-phenylbutanamide
CID 110306164
3-(4-methylphenyl)-N-[(1S)-2-(4-methylpiperazin-1-yl)-2-oxo-1-phenylethyl]propanamide
CID 110306196
1-butan-2-yl-3-(2-morpholin-4-yl-2-oxo-1-phenylethyl)urea
CID 110626175
ethyl N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]carbamate
CID 110286950
N-[2-(4-methylpiperazin-1-yl)-2-oxo-1-phenylethyl]-4-pyridin-3-ylbutanamide
CID 110626227
N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide
CID 55779002
(E)-2-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]-3-phenylprop-2-enamide
CID 110306183

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide?
The IUPAC name of 5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide (CID 110306179) is 5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide.
What is the SMILES notation for 5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide?
The canonical SMILES for 5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide is O=C(CCCCc1ccc(F)cc1)N[C@H](C(=O)N1CCOCC1)c1ccccc1.
What is the InChIKey of 5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide?
The InChIKey is CHYYQTDLNRNQLH-QFIPXVFZSA-N. The full InChI is InChI=1S/C23H27FN2O3/c24-20-12-10-18(11-13-20)6-4-5-9-21(27)25-22(19-7-2-1-3-8-19)23(28)26-14-16-29-17-15-26/h1-3,7-8,10-13,22H,4-6,9,14-17H2,(H,25,27)/t22-/m0/s1.
What are the key properties of 5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide?
5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide has a molecular weight of 398.48 g/mol, XLogP of 3.25, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]pentanamide is sourced from PubChem (CID 110306179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).