(2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride

C17H21ClN2O2 — CID 56673958

IUPAC(2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride
SMILESCOC[C@@H](N)C(=O)NCc1ccc(-c2ccccc2)cc1.Cl
InChIInChI=1S/C17H20N2O2.ClH/c1-21-12-16(18)17(20)19-11-13-7-9-15(10-8-13)14-5-3-2-4-6-14;/h2-10,16H,11-12,18H2,1H3,(H,19,20);1H/t16-;/m1./s1
InChIKeyUTQJKQMJLSURNE-PKLMIRHRSA-N
MW320.82 g/mol
LogP2.37
Rot. Bonds6

About (2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride

(2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride (PubChem CID 56673958) has the molecular formula C17H21ClN2O2 and a molecular weight of 320.82 g/mol. Its IUPAC name is (2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride
PubChem CID56673958
Molecular FormulaC17H21ClN2O2
Molecular Weight320.82 g/mol
Exact Mass320.13
IUPAC Name(2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride
SMILESCOC[C@@H](N)C(=O)NCc1ccc(-c2ccccc2)cc1.Cl
InChIInChI=1S/C17H20N2O2.ClH/c1-21-12-16(18)17(20)19-11-13-7-9-15(10-8-13)14-5-3-2-4-6-14;/h2-10,16H,11-12,18H2,1H3,(H,19,20);1H/t16-;/m1./s1
InChIKeyUTQJKQMJLSURNE-PKLMIRHRSA-N
XLogP2.37
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.82
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride?
The IUPAC name of (2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride (CID 56673958) is (2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride.
What is the SMILES notation for (2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride?
The canonical SMILES for (2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride is COC[C@@H](N)C(=O)NCc1ccc(-c2ccccc2)cc1.Cl.
What is the InChIKey of (2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride?
The InChIKey is UTQJKQMJLSURNE-PKLMIRHRSA-N. The full InChI is InChI=1S/C17H20N2O2.ClH/c1-21-12-16(18)17(20)19-11-13-7-9-15(10-8-13)14-5-3-2-4-6-14;/h2-10,16H,11-12,18H2,1H3,(H,19,20);1H/t16-;/m1./s1.
What are the key properties of (2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride?
(2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride has a molecular weight of 320.82 g/mol, XLogP of 2.37, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-methoxy-N-[(4-phenylphenyl)methyl]propanamide;hydrochloride is sourced from PubChem (CID 56673958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).