N-piperidin-3-ylbenzamide

C12H16N2O — CID 22017045

IUPACN-piperidin-3-ylbenzamide
SMILESO=C(NC1CCCNC1)c1ccccc1
InChIInChI=1S/C12H16N2O/c15-12(10-5-2-1-3-6-10)14-11-7-4-8-13-9-11/h1-3,5-6,11,13H,4,7-9H2,(H,14,15)
InChIKeyZFLKDMGBVZHBAC-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.17
Rot. Bonds2

About N-piperidin-3-ylbenzamide

N-piperidin-3-ylbenzamide (PubChem CID 22017045) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is N-piperidin-3-ylbenzamide.

Molecular Properties

Compound NameN-piperidin-3-ylbenzamide
PubChem CID22017045
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC NameN-piperidin-3-ylbenzamide
SMILESO=C(NC1CCCNC1)c1ccccc1
InChIInChI=1S/C12H16N2O/c15-12(10-5-2-1-3-6-10)14-11-7-4-8-13-9-11/h1-3,5-6,11,13H,4,7-9H2,(H,14,15)
InChIKeyZFLKDMGBVZHBAC-UHFFFAOYSA-N
XLogP1.17
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4S)-azepan-4-yl]benzamide
CID 146196053
4-amino-N-[(3S)-piperidin-3-yl]benzamide
CID 89225185
3-bromo-N-piperidin-3-ylbenzamide
CID 63321592
N-piperidin-3-yl-4-pyrrol-1-ylbenzamide
CID 127187403
4-(dimethylamino)-N-piperidin-3-ylbenzamide
CID 43146815
N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide
CID 15096814
1-phenyl-N-[(3R)-piperidin-3-yl]pyrazole-4-carboxamide
CID 28742838
6-(azonan-1-yl)-N-[(3R)-pyrrolidin-3-yl]cyclodeca-1,3,5,7,9-pentaene-1-carboxamide
CID 139502337
3-(dimethylamino)-N-[(3S)-piperidin-3-yl]benzamide
CID 104982407
N-[(3S)-piperidin-3-yl]thiophene-3-carboxamide
CID 71645364
2-amino-N-piperidin-3-ylbenzamide
CID 70159342
N-[1-oxo-3-phenyl-1-(piperidin-3-ylamino)propan-2-yl]benzamide;hydrochloride
CID 119424821

Frequently Asked Questions

What is the IUPAC name of N-piperidin-3-ylbenzamide?
The IUPAC name of N-piperidin-3-ylbenzamide (CID 22017045) is N-piperidin-3-ylbenzamide.
What is the SMILES notation for N-piperidin-3-ylbenzamide?
The canonical SMILES for N-piperidin-3-ylbenzamide is O=C(NC1CCCNC1)c1ccccc1.
What is the InChIKey of N-piperidin-3-ylbenzamide?
The InChIKey is ZFLKDMGBVZHBAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c15-12(10-5-2-1-3-6-10)14-11-7-4-8-13-9-11/h1-3,5-6,11,13H,4,7-9H2,(H,14,15).
What are the key properties of N-piperidin-3-ylbenzamide?
N-piperidin-3-ylbenzamide has a molecular weight of 204.27 g/mol, XLogP of 1.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-ylbenzamide is sourced from PubChem (CID 22017045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).