2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride

C22H29ClN2O2 — CID 120783183

IUPAC2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride
SMILESCl.NC(C(=O)NCCC(c1ccccc1)c1ccccc1)C1CCOCC1
InChIInChI=1S/C22H28N2O2.ClH/c23-21(19-12-15-26-16-13-19)22(25)24-14-11-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18;/h1-10,19-21H,11-16,23H2,(H,24,25);1H
InChIKeyKQGMEZBIRLZLCQ-UHFFFAOYSA-N
MW388.94 g/mol
LogP3.50
Rot. Bonds7

About 2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride

2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride (PubChem CID 120783183) has the molecular formula C22H29ClN2O2 and a molecular weight of 388.94 g/mol. Its IUPAC name is 2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride
PubChem CID120783183
Molecular FormulaC22H29ClN2O2
Molecular Weight388.94 g/mol
Exact Mass388.19
IUPAC Name2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride
SMILESCl.NC(C(=O)NCCC(c1ccccc1)c1ccccc1)C1CCOCC1
InChIInChI=1S/C22H28N2O2.ClH/c23-21(19-12-15-26-16-13-19)22(25)24-14-11-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18;/h1-10,19-21H,11-16,23H2,(H,24,25);1H
InChIKeyKQGMEZBIRLZLCQ-UHFFFAOYSA-N
XLogP3.50
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.94
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-benzyl-2-(oxan-4-yl)acetamide
CID 120782611
2-amino-N-(2-morpholin-4-yl-2-phenylethyl)-2-(oxan-4-yl)acetamide
CID 120798354
2-amino-N-[2-(2,6-difluorophenyl)ethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120787345
2-amino-2-(oxan-4-yl)-N-(4-phenylbutan-2-yl)acetamide;hydrochloride
CID 120782923
2-amino-N-[2-(2,6-dichlorophenyl)ethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120789587
2-amino-N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]-2-(oxan-4-yl)acetamide
CID 120798822
2-amino-2-(oxan-4-yl)-N-propylacetamide
CID 120783160
2-amino-2-(oxan-4-yl)-N-(1-phenylpentan-2-yl)acetamide;hydrochloride
CID 120791991
2-amino-N-[2-(benzimidazol-1-yl)ethyl]-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120797737
2-amino-N-(naphthalen-1-ylmethyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120786171
(2R)-N-[(3R)-3-hydroxy-3-(oxan-4-yl)propyl]-2-phenylbutanamide
CID 99996591
2-amino-N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120797063

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride?
The IUPAC name of 2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride (CID 120783183) is 2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride is Cl.NC(C(=O)NCCC(c1ccccc1)c1ccccc1)C1CCOCC1.
What is the InChIKey of 2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride?
The InChIKey is KQGMEZBIRLZLCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O2.ClH/c23-21(19-12-15-26-16-13-19)22(25)24-14-11-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18;/h1-10,19-21H,11-16,23H2,(H,24,25);1H.
What are the key properties of 2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride?
2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride has a molecular weight of 388.94 g/mol, XLogP of 3.50, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,3-diphenylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride is sourced from PubChem (CID 120783183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).