N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride

C15H23ClN2O — CID 120670782

IUPACN-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride
SMILESCC1(C)CCCNC1CNC(=O)c1ccccc1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-15(2)9-6-10-16-13(15)11-17-14(18)12-7-4-3-5-8-12;/h3-5,7-8,13,16H,6,9-11H2,1-2H3,(H,17,18);1H
InChIKeySLCNZMCVIILKES-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.62
Rot. Bonds3

About N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride

N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride (PubChem CID 120670782) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride.

Molecular Properties

Compound NameN-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride
PubChem CID120670782
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC NameN-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride
SMILESCC1(C)CCCNC1CNC(=O)c1ccccc1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-15(2)9-6-10-16-13(15)11-17-14(18)12-7-4-3-5-8-12;/h3-5,7-8,13,16H,6,9-11H2,1-2H3,(H,17,18);1H
InChIKeySLCNZMCVIILKES-UHFFFAOYSA-N
XLogP2.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3,3-dimethylpiperidin-2-yl)methyl]quinoline-6-carboxamide
CID 120670665
N-[(3,3-dimethylpiperidin-2-yl)methyl]furan-2-carboxamide;hydrochloride
CID 120670986
N-[(3,3-dimethylpiperidin-2-yl)methyl]-3,4-diethoxybenzamide;hydrochloride
CID 120671025
N-[(3,3-dimethylpiperidin-2-yl)methyl]isoquinoline-1-carboxamide;dihydrochloride
CID 120670834
N-[(3,3-dimethylpiperidin-2-yl)methyl]-5-methylpyridine-3-carboxamide;dihydrochloride
CID 120671038
N-[(3,3-dimethylpiperidin-2-yl)methyl]-6-methylpyridine-2-carboxamide;dihydrochloride
CID 120671077
N-[(3,3-dimethylpiperidin-2-yl)methyl]-2-(4-methylphenyl)acetamide;hydrochloride
CID 120670985
N-[(3,3-dimethylpiperidin-2-yl)methyl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 120671037
N-[(3,3-dimethylpiperidin-2-yl)methyl]-5-methyl-1,2-oxazole-3-carboxamide;hydrochloride
CID 120670803
2-bromo-N-[(3,3-dimethylpiperidin-2-yl)methyl]-4-fluorobenzamide;hydrochloride
CID 120670746
4-bromo-N-[(3,3-dimethylpiperidin-2-yl)methyl]-2-fluorobenzamide;hydrochloride
CID 120670694
N-[(3,3-dimethylpiperidin-2-yl)methyl]-1-methylcyclopropane-1-carboxamide
CID 120670741

Frequently Asked Questions

What is the IUPAC name of N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride?
The IUPAC name of N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride (CID 120670782) is N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride.
What is the SMILES notation for N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride?
The canonical SMILES for N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride is CC1(C)CCCNC1CNC(=O)c1ccccc1.Cl.
What is the InChIKey of N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride?
The InChIKey is SLCNZMCVIILKES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-15(2)9-6-10-16-13(15)11-17-14(18)12-7-4-3-5-8-12;/h3-5,7-8,13,16H,6,9-11H2,1-2H3,(H,17,18);1H.
What are the key properties of N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride?
N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,3-dimethylpiperidin-2-yl)methyl]benzamide;hydrochloride is sourced from PubChem (CID 120670782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).