N-(4-oxopentyl)piperidine-4-carboxamide

C11H20N2O2 — CID 172589492

IUPACN-(4-oxopentyl)piperidine-4-carboxamide
SMILESCC(=O)CCCNC(=O)C1CCNCC1
InChIInChI=1S/C11H20N2O2/c1-9(14)3-2-6-13-11(15)10-4-7-12-8-5-10/h10,12H,2-8H2,1H3,(H,13,15)
InChIKeyVJJSAHPIMNRLEL-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.47
Rot. Bonds5

About N-(4-oxopentyl)piperidine-4-carboxamide

N-(4-oxopentyl)piperidine-4-carboxamide (PubChem CID 172589492) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N-(4-oxopentyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-oxopentyl)piperidine-4-carboxamide
PubChem CID172589492
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN-(4-oxopentyl)piperidine-4-carboxamide
SMILESCC(=O)CCCNC(=O)C1CCNCC1
InChIInChI=1S/C11H20N2O2/c1-9(14)3-2-6-13-11(15)10-4-7-12-8-5-10/h10,12H,2-8H2,1H3,(H,13,15)
InChIKeyVJJSAHPIMNRLEL-UHFFFAOYSA-N
XLogP0.47
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.47
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

ethane;1-methylpyrrolidine;N-(4-oxopentyl)piperidine-4-carboxamide
CID 172589491
N-[4-(diethylamino)-4-oxobutyl]piperidine-4-carboxamide
CID 119291998
N-[2-(methylamino)ethyl]piperidine-4-carboxamide
CID 118234588
N-(4,4,4-trifluorobutyl)piperidine-4-carboxamide
CID 81433066
N-(6-methylsulfanylhexyl)piperidine-4-carboxamide
CID 114125387
N-[(E)-pent-3-enyl]piperidine-4-carboxamide
CID 115976386
N-[4-(diethylamino)butyl]piperidine-4-carboxamide;dihydrochloride
CID 119852526
ethane;molecular hydrogen;N-(3-pyrrolidin-1-ylpropyl)piperidine-4-carboxamide
CID 142349997
2-amino-6-(piperidine-4-carbonylamino)hexanoic acid;ethane
CID 177180760
N-(aminomethyl)piperidine-4-carboxamide;ethane
CID 167467064
N-[3-[cyclohexyl(methyl)amino]propyl]piperidine-4-carboxamide
CID 60981241
N-[6-[4-(3-methylbutanoyl)piperazin-1-yl]-6-oxohexyl]piperidine-4-carboxamide;hydrochloride
CID 119316230

Frequently Asked Questions

What is the IUPAC name of N-(4-oxopentyl)piperidine-4-carboxamide?
The IUPAC name of N-(4-oxopentyl)piperidine-4-carboxamide (CID 172589492) is N-(4-oxopentyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(4-oxopentyl)piperidine-4-carboxamide?
The canonical SMILES for N-(4-oxopentyl)piperidine-4-carboxamide is CC(=O)CCCNC(=O)C1CCNCC1.
What is the InChIKey of N-(4-oxopentyl)piperidine-4-carboxamide?
The InChIKey is VJJSAHPIMNRLEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-9(14)3-2-6-13-11(15)10-4-7-12-8-5-10/h10,12H,2-8H2,1H3,(H,13,15).
What are the key properties of N-(4-oxopentyl)piperidine-4-carboxamide?
N-(4-oxopentyl)piperidine-4-carboxamide has a molecular weight of 212.29 g/mol, XLogP of 0.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxopentyl)piperidine-4-carboxamide is sourced from PubChem (CID 172589492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).