(2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide

C23H24N2O3 — CID 142479950

IUPAC(2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide
SMILESN[C@H](CO)C(=O)Nc1cccc(Oc2ccc(CCc3ccccc3)cc2)c1
InChIInChI=1S/C23H24N2O3/c24-22(16-26)23(27)25-19-7-4-8-21(15-19)28-20-13-11-18(12-14-20)10-9-17-5-2-1-3-6-17/h1-8,11-15,22,26H,9-10,16,24H2,(H,25,27)/t22-/m1/s1
InChIKeyQDNFUGWXEZESFF-JOCHJYFZSA-N
MW376.46 g/mol
LogP3.52
Rot. Bonds8

About (2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide

(2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide (PubChem CID 142479950) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is (2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide
PubChem CID142479950
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC Name(2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide
SMILESN[C@H](CO)C(=O)Nc1cccc(Oc2ccc(CCc3ccccc3)cc2)c1
InChIInChI=1S/C23H24N2O3/c24-22(16-26)23(27)25-19-7-4-8-21(15-19)28-20-13-11-18(12-14-20)10-9-17-5-2-1-3-6-17/h1-8,11-15,22,26H,9-10,16,24H2,(H,25,27)/t22-/m1/s1
InChIKeyQDNFUGWXEZESFF-JOCHJYFZSA-N
XLogP3.52
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-hydroxy-N-[3-(3-phenylphenoxy)phenyl]propanamide
CID 135387436
2-amino-N-(4-phenoxyphenyl)-3-phenylpropanamide
CID 43841950
(2S)-2-amino-N-[4-(4-chlorophenoxy)phenyl]-4-phenylbutanamide
CID 67010614
2-methyl-N-(3-phenoxyphenyl)butanamide
CID 53364670
(2S)-2-amino-N-[4-(4-fluorophenoxy)phenyl]-5-phenylpentanamide
CID 67009207
2-amino-N-(3-ethoxyphenyl)-3-phenylpropanamide
CID 60927036
2-amino-N-(3-hydroxyphenyl)-4-phenylbutanamide
CID 114927368
2-amino-N-(3-iodophenyl)-3-phenylpropanamide
CID 43124635
(2S)-N-(3-acetamidophenyl)-2-amino-3-phenylpropanamide
CID 22691247
(2S)-2-amino-N-(3-cyclopentyloxyphenyl)-3-phenylpropanamide;hydrochloride
CID 119284749
1-(aminomethyl)-N-(3-phenoxyphenyl)cyclopropane-1-carboxamide
CID 80588714
[(2R)-2-amino-3-oxo-3-(3-phenylmethoxyanilino)propyl] 2,2,2-trifluoroacetate
CID 135386519

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide?
The IUPAC name of (2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide (CID 142479950) is (2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide.
What is the SMILES notation for (2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide?
The canonical SMILES for (2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide is N[C@H](CO)C(=O)Nc1cccc(Oc2ccc(CCc3ccccc3)cc2)c1.
What is the InChIKey of (2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide?
The InChIKey is QDNFUGWXEZESFF-JOCHJYFZSA-N. The full InChI is InChI=1S/C23H24N2O3/c24-22(16-26)23(27)25-19-7-4-8-21(15-19)28-20-13-11-18(12-14-20)10-9-17-5-2-1-3-6-17/h1-8,11-15,22,26H,9-10,16,24H2,(H,25,27)/t22-/m1/s1.
What are the key properties of (2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide?
(2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide has a molecular weight of 376.46 g/mol, XLogP of 3.52, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-hydroxy-N-[3-[4-(2-phenylethyl)phenoxy]phenyl]propanamide is sourced from PubChem (CID 142479950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).