N-[3-(4-aminopiperidin-1-yl)propyl]benzamide

C15H23N3O — CID 118533812

IUPACN-[3-(4-aminopiperidin-1-yl)propyl]benzamide
SMILESNC1CCN(CCCNC(=O)c2ccccc2)CC1
InChIInChI=1S/C15H23N3O/c16-14-7-11-18(12-8-14)10-4-9-17-15(19)13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12,16H2,(H,17,19)
InChIKeyPRVMTRNRZPOUHN-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.23
Rot. Bonds5

About N-[3-(4-aminopiperidin-1-yl)propyl]benzamide

N-[3-(4-aminopiperidin-1-yl)propyl]benzamide (PubChem CID 118533812) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-[3-(4-aminopiperidin-1-yl)propyl]benzamide.

Molecular Properties

Compound NameN-[3-(4-aminopiperidin-1-yl)propyl]benzamide
PubChem CID118533812
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-[3-(4-aminopiperidin-1-yl)propyl]benzamide
SMILESNC1CCN(CCCNC(=O)c2ccccc2)CC1
InChIInChI=1S/C15H23N3O/c16-14-7-11-18(12-8-14)10-4-9-17-15(19)13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12,16H2,(H,17,19)
InChIKeyPRVMTRNRZPOUHN-UHFFFAOYSA-N
XLogP1.23
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-(4-ethylpiperazin-1-yl)butyl]benzamide
CID 110442914
N-[4-oxo-4-(3-piperazin-1-ylpropylamino)butyl]benzamide
CID 119394389
N-[3-oxo-3-[3-(4-phenylpiperazin-1-yl)propylamino]propyl]benzamide
CID 43071347
N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]benzamide
CID 71271945
N-[3-(2-methylpiperidin-1-yl)propyl]benzamide
CID 60668475
N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide
CID 100628883
N-[2-(1-sulfamoylpiperidin-4-yl)ethyl]benzamide
CID 69135491
4-[2-(4-phenylpiperidin-1-yl)ethylcarbamoyl]benzoic acid
CID 74239784
N-[2-oxo-2-(3-piperazin-1-ylpropylamino)ethyl]benzamide;hydrochloride
CID 119393183
1-N,4-N-bis(3-morpholin-4-ylpropyl)benzene-1,4-dicarboxamide;hydrochloride
CID 54609927
4-phenyl-N-(4-piperazin-1-ylbutyl)benzamide
CID 144947702
N-[3-(4-hydroxypiperidin-1-yl)propyl]-3-nitrobenzamide
CID 111429688

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-aminopiperidin-1-yl)propyl]benzamide?
The IUPAC name of N-[3-(4-aminopiperidin-1-yl)propyl]benzamide (CID 118533812) is N-[3-(4-aminopiperidin-1-yl)propyl]benzamide.
What is the SMILES notation for N-[3-(4-aminopiperidin-1-yl)propyl]benzamide?
The canonical SMILES for N-[3-(4-aminopiperidin-1-yl)propyl]benzamide is NC1CCN(CCCNC(=O)c2ccccc2)CC1.
What is the InChIKey of N-[3-(4-aminopiperidin-1-yl)propyl]benzamide?
The InChIKey is PRVMTRNRZPOUHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c16-14-7-11-18(12-8-14)10-4-9-17-15(19)13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12,16H2,(H,17,19).
What are the key properties of N-[3-(4-aminopiperidin-1-yl)propyl]benzamide?
N-[3-(4-aminopiperidin-1-yl)propyl]benzamide has a molecular weight of 261.37 g/mol, XLogP of 1.23, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-aminopiperidin-1-yl)propyl]benzamide is sourced from PubChem (CID 118533812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).