N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide

C19H15FN2O3 — CID 51475340

IUPACN-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide
SMILESNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1ccccc1
InChIInChI=1S/C19H15FN2O3/c20-14-8-6-12(7-9-14)15-10-11-16(25-15)19(24)22-17(18(21)23)13-4-2-1-3-5-13/h1-11,17H,(H2,21,23)(H,22,24)/t17-/m0/s1
InChIKeyQHOCWXGJNOAJFY-KRWDZBQOSA-N
MW338.34 g/mol
LogP3.04
Rot. Bonds5

About N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide

N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide (PubChem CID 51475340) has the molecular formula C19H15FN2O3 and a molecular weight of 338.34 g/mol. Its IUPAC name is N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide
PubChem CID51475340
Molecular FormulaC19H15FN2O3
Molecular Weight338.34 g/mol
Exact Mass338.11
IUPAC NameN-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide
SMILESNC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1ccccc1
InChIInChI=1S/C19H15FN2O3/c20-14-8-6-12(7-9-14)15-10-11-16(25-15)19(24)22-17(18(21)23)13-4-2-1-3-5-13/h1-11,17H,(H2,21,23)(H,22,24)/t17-/m0/s1
InChIKeyQHOCWXGJNOAJFY-KRWDZBQOSA-N
XLogP3.04
TPSA85.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.34
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-fluorophenyl)-N-propan-2-ylfuran-2-carboxamide
CID 4290851
(2S)-2-[[5-(4-fluorophenyl)furan-2-carbonyl]amino]-3-methylbutanoic acid
CID 94317037
N-(2-amino-2-oxo-1-phenylethyl)-2-(4-fluorophenyl)-1,3-thiazole-4-carboxamide
CID 78835538
N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-5-(4-fluorophenyl)furan-2-carboxamide
CID 17424931
5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide
CID 51185180
(2R)-2-[[5-(4-fluorophenyl)furan-2-carbonyl]amino]pentanedioic acid
CID 40814315
methyl 2-[[5-(4-fluorophenyl)furan-2-carbonyl]amino]-4-methylpentanoate
CID 3646174
(2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide
CID 33406037
N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide
CID 9084734
N-(2-chlorophenyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 3436050
N-[(1S)-2-amino-2-oxo-1-phenylethyl]-3-(5-phenylfuran-2-yl)propanamide
CID 42377200
5-(4-fluorophenyl)-N'-[2-(4-fluorophenyl)acetyl]furan-2-carbohydrazide
CID 31725805

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide?
The IUPAC name of N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide (CID 51475340) is N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide.
What is the SMILES notation for N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide?
The canonical SMILES for N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide is NC(=O)[C@@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1ccccc1.
What is the InChIKey of N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide?
The InChIKey is QHOCWXGJNOAJFY-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H15FN2O3/c20-14-8-6-12(7-9-14)15-10-11-16(25-15)19(24)22-17(18(21)23)13-4-2-1-3-5-13/h1-11,17H,(H2,21,23)(H,22,24)/t17-/m0/s1.
What are the key properties of N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide?
N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide has a molecular weight of 338.34 g/mol, XLogP of 3.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide is sourced from PubChem (CID 51475340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).