(2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide

C24H28N2O3 — CID 67605455

IUPAC(2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide
SMILESCN(CCc1ccccc1OCCO)C(=O)[C@H](N)Cc1cccc2ccccc12
InChIInChI=1S/C24H28N2O3/c1-26(14-13-19-8-3-5-12-23(19)29-16-15-27)24(28)22(25)17-20-10-6-9-18-7-2-4-11-21(18)20/h2-12,22,27H,13-17,25H2,1H3/t22-/m1/s1
InChIKeyPPUBEQUAOZGQOY-JOCHJYFZSA-N
MW392.50 g/mol
LogP2.78
Rot. Bonds9

About (2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide

(2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide (PubChem CID 67605455) has the molecular formula C24H28N2O3 and a molecular weight of 392.50 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide
PubChem CID67605455
Molecular FormulaC24H28N2O3
Molecular Weight392.50 g/mol
Exact Mass392.21
IUPAC Name(2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide
SMILESCN(CCc1ccccc1OCCO)C(=O)[C@H](N)Cc1cccc2ccccc12
InChIInChI=1S/C24H28N2O3/c1-26(14-13-19-8-3-5-12-23(19)29-16-15-27)24(28)22(25)17-20-10-6-9-18-7-2-4-11-21(18)20/h2-12,22,27H,13-17,25H2,1H3/t22-/m1/s1
InChIKeyPPUBEQUAOZGQOY-JOCHJYFZSA-N
XLogP2.78
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.50
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide?
The IUPAC name of (2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide (CID 67605455) is (2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide?
The canonical SMILES for (2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide is CN(CCc1ccccc1OCCO)C(=O)[C@H](N)Cc1cccc2ccccc12.
What is the InChIKey of (2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide?
The InChIKey is PPUBEQUAOZGQOY-JOCHJYFZSA-N. The full InChI is InChI=1S/C24H28N2O3/c1-26(14-13-19-8-3-5-12-23(19)29-16-15-27)24(28)22(25)17-20-10-6-9-18-7-2-4-11-21(18)20/h2-12,22,27H,13-17,25H2,1H3/t22-/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide?
(2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide has a molecular weight of 392.50 g/mol, XLogP of 2.78, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-[2-(2-hydroxyethoxy)phenyl]ethyl]-N-methyl-3-naphthalen-1-ylpropanamide is sourced from PubChem (CID 67605455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).