3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride

C15H23ClN2O — CID 172654397

IUPAC3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride
SMILESCC(C)NC(=O)c1cccc(C2CCCNC2)c1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-11(2)17-15(18)13-6-3-5-12(9-13)14-7-4-8-16-10-14;/h3,5-6,9,11,14,16H,4,7-8,10H2,1-2H3,(H,17,18);1H
InChIKeyYPICOSFYCKFMPT-UHFFFAOYSA-N
MW282.82 g/mol
LogP2.71
Rot. Bonds3

About 3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride

3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride (PubChem CID 172654397) has the molecular formula C15H23ClN2O and a molecular weight of 282.82 g/mol. Its IUPAC name is 3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride.

Molecular Properties

Compound Name3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride
PubChem CID172654397
Molecular FormulaC15H23ClN2O
Molecular Weight282.82 g/mol
Exact Mass282.15
IUPAC Name3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride
SMILESCC(C)NC(=O)c1cccc(C2CCCNC2)c1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-11(2)17-15(18)13-6-3-5-12(9-13)14-7-4-8-16-10-14;/h3,5-6,9,11,14,16H,4,7-8,10H2,1-2H3,(H,17,18);1H
InChIKeyYPICOSFYCKFMPT-UHFFFAOYSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.82
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 3-[(3R)-piperidin-3-yl]benzoate;hydrochloride
CID 45074282
N-cyclohexyl-3-piperidin-3-ylbenzamide;hydrochloride
CID 172654417
N-butyl-3-piperidin-3-ylbenzamide
CID 172654408
N-[1-(methoxymethyl)cyclopentyl]-3-[(3S)-piperidin-3-yl]benzamide
CID 97188264
N-[(2,5-dimethylpyrazol-3-yl)methyl]-3-[(3S)-piperidin-3-yl]benzamide
CID 99939569
piperidin-1-yl-(3-piperidin-3-ylphenyl)methanone;hydrochloride
CID 172654432
3-methyl-N-(1-piperidin-3-ylethyl)benzamide
CID 43523133
N-[[3-(methoxymethyl)-1H-pyrazol-5-yl]methyl]-3-[(3R)-piperidin-3-yl]benzamide
CID 97211128
N-[[1-(cyclopropanecarbonyl)piperidin-4-yl]methyl]-3-piperidin-3-ylbenzamide
CID 77097142
N-(2-amino-5-fluorophenyl)-3-piperidin-3-ylbenzamide
CID 167775583
N-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methyl]-3-piperidin-3-ylbenzamide
CID 167919058
3-fluoro-N-(1-piperidin-3-ylethyl)benzamide
CID 43523136

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride?
The IUPAC name of 3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride (CID 172654397) is 3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride.
What is the SMILES notation for 3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride?
The canonical SMILES for 3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride is CC(C)NC(=O)c1cccc(C2CCCNC2)c1.Cl.
What is the InChIKey of 3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride?
The InChIKey is YPICOSFYCKFMPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-11(2)17-15(18)13-6-3-5-12(9-13)14-7-4-8-16-10-14;/h3,5-6,9,11,14,16H,4,7-8,10H2,1-2H3,(H,17,18);1H.
What are the key properties of 3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride?
3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride has a molecular weight of 282.82 g/mol, XLogP of 2.71, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-3-yl-N-propan-2-ylbenzamide;hydrochloride is sourced from PubChem (CID 172654397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).