(2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide

C19H17ClN2O2 — CID 33475058

IUPAC(2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide
SMILESNC(=O)[C@@H](NCc1ccc(-c2ccc(Cl)cc2)o1)c1ccccc1
InChIInChI=1S/C19H17ClN2O2/c20-15-8-6-13(7-9-15)17-11-10-16(24-17)12-22-18(19(21)23)14-4-2-1-3-5-14/h1-11,18,22H,12H2,(H2,21,23)/t18-/m0/s1
InChIKeyYPNIZHFLOFVGLC-SFHVURJKSA-N
MW340.81 g/mol
LogP3.92
Rot. Bonds6

About (2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide

(2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide (PubChem CID 33475058) has the molecular formula C19H17ClN2O2 and a molecular weight of 340.81 g/mol. Its IUPAC name is (2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide
PubChem CID33475058
Molecular FormulaC19H17ClN2O2
Molecular Weight340.81 g/mol
Exact Mass340.10
IUPAC Name(2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide
SMILESNC(=O)[C@@H](NCc1ccc(-c2ccc(Cl)cc2)o1)c1ccccc1
InChIInChI=1S/C19H17ClN2O2/c20-15-8-6-13(7-9-15)17-11-10-16(24-17)12-22-18(19(21)23)14-4-2-1-3-5-14/h1-11,18,22H,12H2,(H2,21,23)/t18-/m0/s1
InChIKeyYPNIZHFLOFVGLC-SFHVURJKSA-N
XLogP3.92
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.81
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[[5-(2-fluorophenyl)furan-2-yl]methylamino]-2-phenylacetamide
CID 95042639
2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-1-phenylpropan-1-ol;hydrochloride
CID 17332091
(2S)-2-[[4-(4-chlorophenoxy)phenyl]methylamino]-2-phenylacetamide
CID 151046372
(2S)-2-[(2-chlorophenyl)methylamino]-2-phenylacetamide
CID 33401995
N-[(1S)-2-amino-2-oxo-1-phenylethyl]-3-(5-phenylfuran-2-yl)propanamide
CID 42377200
[(1R)-2-(carbamoylamino)-2-oxo-1-phenylethyl]-[[5-(4-chlorophenyl)furan-2-yl]methyl]-methylazanium
CID 9208318
N-[2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-oxoethyl]-2-phenylacetamide
CID 9120196
(2R)-2-[(2-fluorophenyl)methylamino]-2-phenylacetamide
CID 33473493
(2S)-2-[2-(4-chlorophenoxy)ethylamino]-2-phenylacetamide
CID 33475459
2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]butan-1-ol
CID 4723603
[5-(4-chlorophenyl)furan-2-yl]methyl N-phenylcarbamate
CID 900055
methyl 4-[5-[[[(1R)-1-phenylethyl]amino]methyl]furan-2-yl]benzoate
CID 8636505

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide?
The IUPAC name of (2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide (CID 33475058) is (2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide.
What is the SMILES notation for (2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide?
The canonical SMILES for (2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide is NC(=O)[C@@H](NCc1ccc(-c2ccc(Cl)cc2)o1)c1ccccc1.
What is the InChIKey of (2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide?
The InChIKey is YPNIZHFLOFVGLC-SFHVURJKSA-N. The full InChI is InChI=1S/C19H17ClN2O2/c20-15-8-6-13(7-9-15)17-11-10-16(24-17)12-22-18(19(21)23)14-4-2-1-3-5-14/h1-11,18,22H,12H2,(H2,21,23)/t18-/m0/s1.
What are the key properties of (2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide?
(2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide has a molecular weight of 340.81 g/mol, XLogP of 3.92, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[[5-(4-chlorophenyl)furan-2-yl]methylamino]-2-phenylacetamide is sourced from PubChem (CID 33475058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).