N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide

C11H22N2O2 — CID 106842133

IUPACN-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide
SMILESCC1(C(=O)NCCCCO)CCNCC1
InChIInChI=1S/C11H22N2O2/c1-11(4-7-12-8-5-11)10(15)13-6-2-3-9-14/h12,14H,2-9H2,1H3,(H,13,15)
InChIKeyABJVDEYLWWVELZ-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.26
Rot. Bonds5

About N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide

N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide (PubChem CID 106842133) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide
PubChem CID106842133
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide
SMILESCC1(C(=O)NCCCCO)CCNCC1
InChIInChI=1S/C11H22N2O2/c1-11(4-7-12-8-5-11)10(15)13-6-2-3-9-14/h12,14H,2-9H2,1H3,(H,13,15)
InChIKeyABJVDEYLWWVELZ-UHFFFAOYSA-N
XLogP0.26
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-methyl-N-(3-methylsulfonylpropyl)piperidine-4-carboxamide
CID 63122628
ethyl 4-[(4-methylpiperidine-4-carbonyl)amino]butanoate
CID 64576191
4-methyl-N-(3-piperidin-1-ylpropyl)piperidine-4-carboxamide
CID 63121401
methyl 3-[(4-methylpiperidine-4-carbonyl)amino]propanoate
CID 63122388
N-(2-ethylsulfinylethyl)-4-methylpiperidine-4-carboxamide
CID 115760353
N-(3-methoxypropyl)-3-methylpyrrolidine-3-carboxamide
CID 63138395
N-(3-cyclopropylpropyl)-3-methylpyrrolidine-3-carboxamide
CID 115740541
N-(5-hydroxypentyl)-3,5-dimethyladamantane-1-carboxamide
CID 107318418
N-[2-(dimethylamino)-2-oxoethyl]-4-methylpiperidine-4-carboxamide
CID 63121296
1-bromo-N-(4-hydroxybutyl)cyclopropane-1-carboxamide
CID 69426128
4-methyl-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide
CID 55177553
N-(3-butoxypropyl)-3-methylpyrrolidine-3-carboxamide
CID 115737915

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide?
The IUPAC name of N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide (CID 106842133) is N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide?
The canonical SMILES for N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide is CC1(C(=O)NCCCCO)CCNCC1.
What is the InChIKey of N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide?
The InChIKey is ABJVDEYLWWVELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-11(4-7-12-8-5-11)10(15)13-6-2-3-9-14/h12,14H,2-9H2,1H3,(H,13,15).
What are the key properties of N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide?
N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.26, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxybutyl)-4-methylpiperidine-4-carboxamide is sourced from PubChem (CID 106842133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).