2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride

C20H27ClN2O — CID 120589227

IUPAC2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride
SMILESCC(C)C(CNC(=O)C(C)(N)c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C20H26N2O.ClH/c1-15(2)18(16-10-6-4-7-11-16)14-22-19(23)20(3,21)17-12-8-5-9-13-17;/h4-13,15,18H,14,21H2,1-3H3,(H,22,23);1H
InChIKeyAXCVQXTXKWFPOF-UHFFFAOYSA-N
MW346.90 g/mol
LogP3.84
Rot. Bonds6

About 2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride

2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride (PubChem CID 120589227) has the molecular formula C20H27ClN2O and a molecular weight of 346.90 g/mol. Its IUPAC name is 2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride
PubChem CID120589227
Molecular FormulaC20H27ClN2O
Molecular Weight346.90 g/mol
Exact Mass346.18
IUPAC Name2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride
SMILESCC(C)C(CNC(=O)C(C)(N)c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C20H26N2O.ClH/c1-15(2)18(16-10-6-4-7-11-16)14-22-19(23)20(3,21)17-12-8-5-9-13-17;/h4-13,15,18H,14,21H2,1-3H3,(H,22,23);1H
InChIKeyAXCVQXTXKWFPOF-UHFFFAOYSA-N
XLogP3.84
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.90
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 65224591
2-amino-2-phenyl-N-[(4-propan-2-ylphenyl)methyl]propanamide;hydrochloride
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2-amino-N-(2-hydroxy-2-thiophen-3-ylethyl)-2-phenylpropanamide;hydrochloride
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2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride
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CID 112840322
2-amino-N-[2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]-2-phenylpropanamide;dihydrochloride
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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride?
The IUPAC name of 2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride (CID 120589227) is 2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride is CC(C)C(CNC(=O)C(C)(N)c1ccccc1)c1ccccc1.Cl.
What is the InChIKey of 2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride?
The InChIKey is AXCVQXTXKWFPOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O.ClH/c1-15(2)18(16-10-6-4-7-11-16)14-22-19(23)20(3,21)17-12-8-5-9-13-17;/h4-13,15,18H,14,21H2,1-3H3,(H,22,23);1H.
What are the key properties of 2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride?
2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride has a molecular weight of 346.90 g/mol, XLogP of 3.84, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-methyl-2-phenylbutyl)-2-phenylpropanamide;hydrochloride is sourced from PubChem (CID 120589227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).