N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride

C21H25ClN2O2 — CID 119457115

IUPACN-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride
SMILESCl.O=C(NC1CC2CCC(C1)N2)C(Oc1ccccc1)c1ccccc1
InChIInChI=1S/C21H24N2O2.ClH/c24-21(23-18-13-16-11-12-17(14-18)22-16)20(15-7-3-1-4-8-15)25-19-9-5-2-6-10-19;/h1-10,16-18,20,22H,11-14H2,(H,23,24);1H
InChIKeyVEVZJVOCFNRIEA-UHFFFAOYSA-N
MW372.90 g/mol
LogP3.63
Rot. Bonds5

About N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride

N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride (PubChem CID 119457115) has the molecular formula C21H25ClN2O2 and a molecular weight of 372.90 g/mol. Its IUPAC name is N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride
PubChem CID119457115
Molecular FormulaC21H25ClN2O2
Molecular Weight372.90 g/mol
Exact Mass372.16
IUPAC NameN-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride
SMILESCl.O=C(NC1CC2CCC(C1)N2)C(Oc1ccccc1)c1ccccc1
InChIInChI=1S/C21H24N2O2.ClH/c24-21(23-18-13-16-11-12-17(14-18)22-16)20(15-7-3-1-4-8-15)25-19-9-5-2-6-10-19;/h1-10,16-18,20,22H,11-14H2,(H,23,24);1H
InChIKeyVEVZJVOCFNRIEA-UHFFFAOYSA-N
XLogP3.63
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.90
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenyl-2-(3-propan-2-ylphenoxy)acetamide;hydrochloride
CID 119456064
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-methyl-2-phenylpentanamide;hydrochloride
CID 119455950
(2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95138736
(2R)-2-phenoxy-2-phenyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95138739
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-(4-methylpiperazin-1-yl)-2-phenylacetamide;dihydrochloride
CID 119458426
(2S)-N-cyclopropyl-2-(3,4-dichlorophenoxy)-2-phenylacetamide
CID 9417632
N-(2-methylpiperidin-4-yl)-2-phenyl-2-(3-propan-2-ylphenoxy)acetamide
CID 120601037
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-(3-chlorophenoxy)propanamide
CID 62229825
N-(8-azabicyclo[3.2.1]octan-3-yl)-4-methyl-3-phenylpentanamide
CID 119455463
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenylmethoxyacetamide;hydrochloride
CID 119457057
2-(3,4-dichlorophenoxy)-2-phenyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119449871
N-(8-azabicyclo[3.2.1]octan-3-yl)-4-phenoxypyridine-2-carboxamide;dihydrochloride
CID 119457932

Frequently Asked Questions

What is the IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride?
The IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride (CID 119457115) is N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride.
What is the SMILES notation for N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride?
The canonical SMILES for N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride is Cl.O=C(NC1CC2CCC(C1)N2)C(Oc1ccccc1)c1ccccc1.
What is the InChIKey of N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride?
The InChIKey is VEVZJVOCFNRIEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O2.ClH/c24-21(23-18-13-16-11-12-17(14-18)22-16)20(15-7-3-1-4-8-15)25-19-9-5-2-6-10-19;/h1-10,16-18,20,22H,11-14H2,(H,23,24);1H.
What are the key properties of N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride?
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride has a molecular weight of 372.90 g/mol, XLogP of 3.63, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride is sourced from PubChem (CID 119457115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).