N-piperidin-4-ylhexanamide;hydrochloride

C11H23ClN2O — CID 47002713

IUPACN-piperidin-4-ylhexanamide;hydrochloride
SMILESCCCCCC(=O)NC1CCNCC1.Cl
InChIInChI=1S/C11H22N2O.ClH/c1-2-3-4-5-11(14)13-10-6-8-12-9-7-10;/h10,12H,2-9H2,1H3,(H,13,14);1H
InChIKeyBSMNNCKBUMROOC-UHFFFAOYSA-N
MW234.77 g/mol
LogP1.86
Rot. Bonds5

About N-piperidin-4-ylhexanamide;hydrochloride

N-piperidin-4-ylhexanamide;hydrochloride (PubChem CID 47002713) has the molecular formula C11H23ClN2O and a molecular weight of 234.77 g/mol. Its IUPAC name is N-piperidin-4-ylhexanamide;hydrochloride.

Molecular Properties

Compound NameN-piperidin-4-ylhexanamide;hydrochloride
PubChem CID47002713
Molecular FormulaC11H23ClN2O
Molecular Weight234.77 g/mol
Exact Mass234.15
IUPAC NameN-piperidin-4-ylhexanamide;hydrochloride
SMILESCCCCCC(=O)NC1CCNCC1.Cl
InChIInChI=1S/C11H22N2O.ClH/c1-2-3-4-5-11(14)13-10-6-8-12-9-7-10;/h10,12H,2-9H2,1H3,(H,13,14);1H
InChIKeyBSMNNCKBUMROOC-UHFFFAOYSA-N
XLogP1.86
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.77
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(azepan-4-yl)dodecanamide
CID 105060891
N-[(3S)-pyrrolidin-3-yl]decanamide
CID 79688087
N',N'-diethyl-N-piperidin-4-ylpentanediamide
CID 119386732
N-cyclobutylhexadecanamide
CID 67041463
N-cyclobutylicosanamide
CID 10384249
N-(2-methylpiperidin-4-yl)hexanamide
CID 106995560
N-cyclohexyltetradecanamide
CID 10244853
N-cycloheptylnonanamide
CID 5045141
N-(4-hydroxycyclohexyl)dodecanamide
CID 61380713
N-(4-oxocyclohexyl)octanamide
CID 43652747
3-butylsulfanyl-N-pyrrolidin-3-ylpropanamide
CID 119454357
N-piperidin-4-yl-N',N'-dipropylbutanediamide
CID 119386125

Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-ylhexanamide;hydrochloride?
The IUPAC name of N-piperidin-4-ylhexanamide;hydrochloride (CID 47002713) is N-piperidin-4-ylhexanamide;hydrochloride.
What is the SMILES notation for N-piperidin-4-ylhexanamide;hydrochloride?
The canonical SMILES for N-piperidin-4-ylhexanamide;hydrochloride is CCCCCC(=O)NC1CCNCC1.Cl.
What is the InChIKey of N-piperidin-4-ylhexanamide;hydrochloride?
The InChIKey is BSMNNCKBUMROOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O.ClH/c1-2-3-4-5-11(14)13-10-6-8-12-9-7-10;/h10,12H,2-9H2,1H3,(H,13,14);1H.
What are the key properties of N-piperidin-4-ylhexanamide;hydrochloride?
N-piperidin-4-ylhexanamide;hydrochloride has a molecular weight of 234.77 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-ylhexanamide;hydrochloride is sourced from PubChem (CID 47002713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).