2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride

C19H25ClN2O2 — CID 120668952

IUPAC2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride
SMILESCc1ccc(C(N)C(=O)NC(C)CC(O)c2ccccc2)cc1.Cl
InChIInChI=1S/C19H24N2O2.ClH/c1-13-8-10-16(11-9-13)18(20)19(23)21-14(2)12-17(22)15-6-4-3-5-7-15;/h3-11,14,17-18,22H,12,20H2,1-2H3,(H,21,23);1H
InChIKeySYHJBERSIMDHHS-UHFFFAOYSA-N
MW348.87 g/mol
LogP3.05
Rot. Bonds6

About 2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride

2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride (PubChem CID 120668952) has the molecular formula C19H25ClN2O2 and a molecular weight of 348.87 g/mol. Its IUPAC name is 2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride
PubChem CID120668952
Molecular FormulaC19H25ClN2O2
Molecular Weight348.87 g/mol
Exact Mass348.16
IUPAC Name2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride
SMILESCc1ccc(C(N)C(=O)NC(C)CC(O)c2ccccc2)cc1.Cl
InChIInChI=1S/C19H24N2O2.ClH/c1-13-8-10-16(11-9-13)18(20)19(23)21-14(2)12-17(22)15-6-4-3-5-7-15;/h3-11,14,17-18,22H,12,20H2,1-2H3,(H,21,23);1H
InChIKeySYHJBERSIMDHHS-UHFFFAOYSA-N
XLogP3.05
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.87
LogP ≤ 53.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-(4-hydroxypentan-2-yl)-2-phenylacetamide
CID 104898348
3-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-methylbutanamide;hydrochloride
CID 120501802
(2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide
CID 81357033
2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide
CID 106151030
5-[(2-amino-2-phenylacetyl)amino]hexanoic acid
CID 82845613
5-[[(2R)-2-amino-2-phenylacetyl]amino]hexanoic acid
CID 82847398
2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide
CID 106151106
2-amino-N-[(2R)-1-hydroxypropan-2-yl]-2-phenylacetamide
CID 107218501
2-amino-N-(5-methylhexan-2-yl)-2-phenylacetamide
CID 43579340
(2S)-2-amino-N-pentan-2-yl-2-phenylacetamide
CID 104897097
2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride
CID 119320621
2-amino-2-phenyl-N-propan-2-ylacetamide;hydrochloride
CID 22262716

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride?
The IUPAC name of 2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride (CID 120668952) is 2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride is Cc1ccc(C(N)C(=O)NC(C)CC(O)c2ccccc2)cc1.Cl.
What is the InChIKey of 2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride?
The InChIKey is SYHJBERSIMDHHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2.ClH/c1-13-8-10-16(11-9-13)18(20)19(23)21-14(2)12-17(22)15-6-4-3-5-7-15;/h3-11,14,17-18,22H,12,20H2,1-2H3,(H,21,23);1H.
What are the key properties of 2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride?
2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride has a molecular weight of 348.87 g/mol, XLogP of 3.05, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride is sourced from PubChem (CID 120668952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).