N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride

C14H29ClN2O2 — CID 119675580

IUPACN-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride
SMILESCCOCCCNC(=O)CC(C)C1CCNCC1.Cl
InChIInChI=1S/C14H28N2O2.ClH/c1-3-18-10-4-7-16-14(17)11-12(2)13-5-8-15-9-6-13;/h12-13,15H,3-11H2,1-2H3,(H,16,17);1H
InChIKeyXLPSDVCRADLSCJ-UHFFFAOYSA-N
MW292.85 g/mol
LogP1.98
Rot. Bonds8

About N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride

N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride (PubChem CID 119675580) has the molecular formula C14H29ClN2O2 and a molecular weight of 292.85 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride
PubChem CID119675580
Molecular FormulaC14H29ClN2O2
Molecular Weight292.85 g/mol
Exact Mass292.19
IUPAC NameN-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride
SMILESCCOCCCNC(=O)CC(C)C1CCNCC1.Cl
InChIInChI=1S/C14H28N2O2.ClH/c1-3-18-10-4-7-16-14(17)11-12(2)13-5-8-15-9-6-13;/h12-13,15H,3-11H2,1-2H3,(H,16,17);1H
InChIKeyXLPSDVCRADLSCJ-UHFFFAOYSA-N
XLogP1.98
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.85
LogP ≤ 51.98
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-ethoxypropyl)-3-piperidin-4-ylbutanamide
CID 119675581
N-[3-(2-methoxyethoxy)propyl]-3-piperidin-4-ylbutanamide
CID 119693914
N-(2-methoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119669583
N-[3-(oxolan-3-ylmethoxy)propyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119800061
methyl 4-(3-piperidin-4-ylbutanoylamino)butanoate
CID 119684765
N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]-3-piperidin-4-ylbutanamide
CID 119812192
N-[3-(3-methoxyphenoxy)propyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119797678
N-[[4-(ethoxymethyl)phenyl]methyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119718287
N-(2-phenoxyethyl)-3-piperidin-4-ylbutanamide
CID 119684535
N-(2-phenylmethoxyethyl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119770174
N-[3-(4-methylpiperazin-1-yl)propyl]-3-piperidin-4-ylbutanamide
CID 119901093
N-(cyclooctylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119741883

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride?
The IUPAC name of N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride (CID 119675580) is N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride.
What is the SMILES notation for N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride?
The canonical SMILES for N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride is CCOCCCNC(=O)CC(C)C1CCNCC1.Cl.
What is the InChIKey of N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride?
The InChIKey is XLPSDVCRADLSCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2.ClH/c1-3-18-10-4-7-16-14(17)11-12(2)13-5-8-15-9-6-13;/h12-13,15H,3-11H2,1-2H3,(H,16,17);1H.
What are the key properties of N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride?
N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride has a molecular weight of 292.85 g/mol, XLogP of 1.98, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-3-piperidin-4-ylbutanamide;hydrochloride is sourced from PubChem (CID 119675580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).