(2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide

C15H13FN2O3 — CID 894565

IUPAC(2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide
SMILESC[C@@H](C(=O)Nc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C15H13FN2O3/c1-10(11-5-7-14(8-6-11)18(20)21)15(19)17-13-4-2-3-12(16)9-13/h2-10H,1H3,(H,17,19)/t10-/m1/s1
InChIKeyFNNGRFUHUKRBOP-SNVBAGLBSA-N
MW288.28 g/mol
LogP3.48
Rot. Bonds4

About (2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide

(2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide (PubChem CID 894565) has the molecular formula C15H13FN2O3 and a molecular weight of 288.28 g/mol. Its IUPAC name is (2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide.

Molecular Properties

Compound Name(2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide
PubChem CID894565
Molecular FormulaC15H13FN2O3
Molecular Weight288.28 g/mol
Exact Mass288.09
IUPAC Name(2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide
SMILESC[C@@H](C(=O)Nc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C15H13FN2O3/c1-10(11-5-7-14(8-6-11)18(20)21)15(19)17-13-4-2-3-12(16)9-13/h2-10H,1H3,(H,17,19)/t10-/m1/s1
InChIKeyFNNGRFUHUKRBOP-SNVBAGLBSA-N
XLogP3.48
TPSA72.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.28
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-(3-fluorophenyl)-2-phenylpropanamide
CID 97038180
N-(3-fluorophenyl)-2-phenylpropanamide
CID 70678315
2-(3-aminophenyl)-N-(3-fluorophenyl)propanamide
CID 106590704
(2R)-N-(4-methoxyphenyl)-2-(4-nitrophenyl)propanamide
CID 2111459
(2S)-N-(4-methoxyphenyl)-2-(4-nitrophenyl)propanamide
CID 2111458
(2R)-N-[4-(dimethylamino)phenyl]-2-(4-nitrophenyl)propanamide
CID 2111469
N'-(3-fluorophenyl)-N-(3-nitrophenyl)oxamide
CID 108513374
3-methyl-N-(3-methylphenyl)-2-(4-nitrophenyl)butanamide
CID 4513664
(2S)-N-(2-bromophenyl)-2-(4-nitrophenyl)propanamide
CID 895338
(2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide
CID 895147
N-(3-fluorophenyl)-2-(4-nitrophenoxy)acetamide
CID 802614
(4-nitrophenyl)methyl N-(3-fluorophenyl)carbamate
CID 134125017

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide?
The IUPAC name of (2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide (CID 894565) is (2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide.
What is the SMILES notation for (2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide?
The canonical SMILES for (2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide is C[C@@H](C(=O)Nc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1.
What is the InChIKey of (2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide?
The InChIKey is FNNGRFUHUKRBOP-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H13FN2O3/c1-10(11-5-7-14(8-6-11)18(20)21)15(19)17-13-4-2-3-12(16)9-13/h2-10H,1H3,(H,17,19)/t10-/m1/s1.
What are the key properties of (2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide?
(2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide has a molecular weight of 288.28 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-fluorophenyl)-2-(4-nitrophenyl)propanamide is sourced from PubChem (CID 894565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).