N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride

C12H25ClN2O2 — CID 119669583

IUPACN-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride
SMILESCOCCNC(=O)CC(C)C1CCNCC1.Cl
InChIInChI=1S/C12H24N2O2.ClH/c1-10(11-3-5-13-6-4-11)9-12(15)14-7-8-16-2;/h10-11,13H,3-9H2,1-2H3,(H,14,15);1H
InChIKeyVJPJDJDRYZLDJN-UHFFFAOYSA-N
MW264.80 g/mol
LogP1.20
Rot. Bonds6

About N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride

N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride (PubChem CID 119669583) has the molecular formula C12H25ClN2O2 and a molecular weight of 264.80 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride
PubChem CID119669583
Molecular FormulaC12H25ClN2O2
Molecular Weight264.80 g/mol
Exact Mass264.16
IUPAC NameN-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride
SMILESCOCCNC(=O)CC(C)C1CCNCC1.Cl
InChIInChI=1S/C12H24N2O2.ClH/c1-10(11-3-5-13-6-4-11)9-12(15)14-7-8-16-2;/h10-11,13H,3-9H2,1-2H3,(H,14,15);1H
InChIKeyVJPJDJDRYZLDJN-UHFFFAOYSA-N
XLogP1.20
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.80
LogP ≤ 51.20
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-[3-(2-methoxyethoxy)propyl]-3-piperidin-4-ylbutanamide
CID 119693914
N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119675580
methyl 4-(3-piperidin-4-ylbutanoylamino)butanoate
CID 119684765
N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide
CID 119675581
N-[[1-(2-methoxyethyl)cyclobutyl]methyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119820386
N-(2-phenoxyethyl)-3-piperidin-4-ylbutanamide
CID 119684535
4-methoxy-N-[2-(3-piperidin-4-ylbutanoylamino)ethyl]benzamide;hydrochloride
CID 119718894
N-(2-phenylmethoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119770174
N-(cyclooctylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119741883
3-piperidin-4-yl-N-[2-(propan-2-ylsulfamoyl)ethyl]butanamide
CID 119758906
3-piperidin-4-yl-N-[2-(2-propan-2-ylphenoxy)ethyl]butanamide;hydrochloride
CID 119784406
N-[[4-(methoxymethyl)phenyl]methyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119718138

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride?
The IUPAC name of N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride (CID 119669583) is N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride.
What is the SMILES notation for N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride?
The canonical SMILES for N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride is COCCNC(=O)CC(C)C1CCNCC1.Cl.
What is the InChIKey of N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride?
The InChIKey is VJPJDJDRYZLDJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2.ClH/c1-10(11-3-5-13-6-4-11)9-12(15)14-7-8-16-2;/h10-11,13H,3-9H2,1-2H3,(H,14,15);1H.
What are the key properties of N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride?
N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride has a molecular weight of 264.80 g/mol, XLogP of 1.20, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride is sourced from PubChem (CID 119669583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).