(2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide

C19H24N2O2 — CID 119286568

IUPAC(2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide
SMILESCCOCc1ccccc1CNC(=O)[C@@H](N)Cc1ccccc1
InChIInChI=1S/C19H24N2O2/c1-2-23-14-17-11-7-6-10-16(17)13-21-19(22)18(20)12-15-8-4-3-5-9-15/h3-11,18H,2,12-14,20H2,1H3,(H,21,22)/t18-/m0/s1
InChIKeyYFLRJRZBCLVPPW-SFHVURJKSA-N
MW312.41 g/mol
LogP2.41
Rot. Bonds8

About (2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide

(2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide (PubChem CID 119286568) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is (2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide
PubChem CID119286568
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name(2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide
SMILESCCOCc1ccccc1CNC(=O)[C@@H](N)Cc1ccccc1
InChIInChI=1S/C19H24N2O2/c1-2-23-14-17-11-7-6-10-16(17)13-21-19(22)18(20)12-15-8-4-3-5-9-15/h3-11,18H,2,12-14,20H2,1H3,(H,21,22)/t18-/m0/s1
InChIKeyYFLRJRZBCLVPPW-SFHVURJKSA-N
XLogP2.41
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[[4-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide;hydrochloride
CID 119286541
(2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]pentanamide
CID 93359004
(2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]propanamide;hydrochloride
CID 119286563
2-amino-N-[[2-[(dimethylamino)methyl]phenyl]methyl]-3-phenylpropanamide;dihydrochloride
CID 119835445
(2R)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3,3-dimethylbutanamide
CID 103928994
N-[[2-(ethoxymethyl)phenyl]methyl]-2,2-diphenylacetamide
CID 55599193
2-amino-N-[(2-chlorophenyl)methyl]-3-phenylpropanamide
CID 24706399
(2R)-2-amino-N-[[2-(phenylmethoxymethyl)phenyl]methyl]propanamide
CID 119286428
3-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylpropanamide
CID 119718321
(2S)-2-amino-N-ethoxy-3-phenylpropanamide
CID 64974630
2-amino-N-ethyl-3-phenylpropanamide;hydrochloride
CID 53409094
2-amino-N-ethoxy-3-phenylpropanamide
CID 64974799

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide?
The IUPAC name of (2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide (CID 119286568) is (2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide.
What is the SMILES notation for (2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide?
The canonical SMILES for (2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide is CCOCc1ccccc1CNC(=O)[C@@H](N)Cc1ccccc1.
What is the InChIKey of (2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide?
The InChIKey is YFLRJRZBCLVPPW-SFHVURJKSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-2-23-14-17-11-7-6-10-16(17)13-21-19(22)18(20)12-15-8-4-3-5-9-15/h3-11,18H,2,12-14,20H2,1H3,(H,21,22)/t18-/m0/s1.
What are the key properties of (2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide?
(2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide has a molecular weight of 312.41 g/mol, XLogP of 2.41, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-3-phenylpropanamide is sourced from PubChem (CID 119286568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).