N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride

C15H21ClN2O — CID 126477922

IUPACN-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride
SMILESCN1C2CCC1CC(NC(=O)c1ccccc1)C2.Cl
InChIInChI=1S/C15H20N2O.ClH/c1-17-13-7-8-14(17)10-12(9-13)16-15(18)11-5-3-2-4-6-11;/h2-6,12-14H,7-10H2,1H3,(H,16,18);1H
InChIKeyJBYVSPDSMOPQQE-UHFFFAOYSA-N
MW280.80 g/mol
LogP2.46
Rot. Bonds2

About N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride

N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride (PubChem CID 126477922) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride.

Molecular Properties

Compound NameN-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride
PubChem CID126477922
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC NameN-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride
SMILESCN1C2CCC1CC(NC(=O)c1ccccc1)C2.Cl
InChIInChI=1S/C15H20N2O.ClH/c1-17-13-7-8-14(17)10-12(9-13)16-15(18)11-5-3-2-4-6-11;/h2-6,12-14H,7-10H2,1H3,(H,16,18);1H
InChIKeyJBYVSPDSMOPQQE-UHFFFAOYSA-N
XLogP2.46
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-N-[(1R,5S)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]benzamide
CID 139083931
3-methyl-N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)azulene-1-carboxamide
CID 54290724
N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2,3-diphenylprop-2-enamide
CID 67845558
4-(aminomethyl)-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)benzamide;dihydrochloride
CID 119892080
3-bromo-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)benzamide
CID 65470115
1-methyl-N-[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-2-phenylindole-3-carboxamide;hydrochloride
CID 70108169
ethane;N-(1-methylpiperidin-4-yl)benzamide
CID 142009687
[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]carbamic acid
CID 67915994
N-[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-2-phenylsulfanylacetamide
CID 11859507
3-(chloromethyl)-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)benzamide
CID 65470268
N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-4-(1,3-oxazol-5-yl)benzamide
CID 167815020
N-(3-aminocyclobutyl)benzamide
CID 43594893

Frequently Asked Questions

What is the IUPAC name of N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride?
The IUPAC name of N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride (CID 126477922) is N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride.
What is the SMILES notation for N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride?
The canonical SMILES for N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride is CN1C2CCC1CC(NC(=O)c1ccccc1)C2.Cl.
What is the InChIKey of N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride?
The InChIKey is JBYVSPDSMOPQQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O.ClH/c1-17-13-7-8-14(17)10-12(9-13)16-15(18)11-5-3-2-4-6-11;/h2-6,12-14H,7-10H2,1H3,(H,16,18);1H.
What are the key properties of N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride?
N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride has a molecular weight of 280.80 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride is sourced from PubChem (CID 126477922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).