(2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide

C23H24N2O3 — CID 163928568

IUPAC(2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide
SMILESCOC[C@H](N)C(=O)Nc1ccc(OCc2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C23H24N2O3/c1-27-16-22(24)23(26)25-20-11-13-21(14-12-20)28-15-17-7-9-19(10-8-17)18-5-3-2-4-6-18/h2-14,22H,15-16,24H2,1H3,(H,25,26)/t22-/m0/s1
InChIKeyRGRBKDZRPQDGFH-QFIPXVFZSA-N
MW376.46 g/mol
LogP3.84
Rot. Bonds8

About (2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide

(2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide (PubChem CID 163928568) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is (2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide.

Molecular Properties

Compound Name(2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide
PubChem CID163928568
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC Name(2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide
SMILESCOC[C@H](N)C(=O)Nc1ccc(OCc2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C23H24N2O3/c1-27-16-22(24)23(26)25-20-11-13-21(14-12-20)28-15-17-7-9-19(10-8-17)18-5-3-2-4-6-18/h2-14,22H,15-16,24H2,1H3,(H,25,26)/t22-/m0/s1
InChIKeyRGRBKDZRPQDGFH-QFIPXVFZSA-N
XLogP3.84
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(4-phenylmethoxyphenyl)pentanamide;hydrochloride
CID 119261538
2-amino-3-methoxy-N-[[4-(phenoxymethyl)phenyl]methyl]propanamide;hydrochloride
CID 120985987
methyl 2-[4-[(2-amino-3-methoxypropanoyl)amino]phenoxy]acetate
CID 81083437
[(2S)-2-amino-3-oxo-3-[4-[3-(4-phenylphenyl)propoxy]anilino]propyl] dihydrogen phosphate
CID 143188439
2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride
CID 68649668
(2S)-2-[(2S)-1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl]sulfanyl-N-(4-phenylmethoxyphenyl)propanamide
CID 98384376
2-amino-3-methoxy-N-[4-[3-(methylamino)-3-oxopropoxy]phenyl]propanamide;hydrochloride
CID 120989161
(2S)-2-amino-N-[4-(4-methylphenoxy)phenyl]-3-phenylmethoxypropanamide
CID 67010016
2-amino-N-[4-(2-methoxyethoxy)phenyl]pentanamide;hydrochloride
CID 119289402
2-amino-N-(4-iodophenyl)-3-methoxypropanamide;hydrochloride
CID 120984756
2-amino-3-methoxy-N-[3-[(4-methoxyphenyl)methoxymethyl]phenyl]propanamide;hydrochloride
CID 120987747
2-amino-N-(4-ethoxyphenyl)-4-methoxybutanamide
CID 55080527

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide?
The IUPAC name of (2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide (CID 163928568) is (2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide.
What is the SMILES notation for (2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide?
The canonical SMILES for (2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide is COC[C@H](N)C(=O)Nc1ccc(OCc2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of (2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide?
The InChIKey is RGRBKDZRPQDGFH-QFIPXVFZSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-27-16-22(24)23(26)25-20-11-13-21(14-12-20)28-15-17-7-9-19(10-8-17)18-5-3-2-4-6-18/h2-14,22H,15-16,24H2,1H3,(H,25,26)/t22-/m0/s1.
What are the key properties of (2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide?
(2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide has a molecular weight of 376.46 g/mol, XLogP of 3.84, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-3-methoxy-N-[4-[(4-phenylphenyl)methoxy]phenyl]propanamide is sourced from PubChem (CID 163928568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).