N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride

C12H23ClN2O — CID 119557894

IUPACN-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride
SMILESCl.O=C(NCCC1CCCNC1)C1CCC1
InChIInChI=1S/C12H22N2O.ClH/c15-12(11-4-1-5-11)14-8-6-10-3-2-7-13-9-10;/h10-11,13H,1-9H2,(H,14,15);1H
InChIKeyWROXDRQWMJLSJF-UHFFFAOYSA-N
MW246.78 g/mol
LogP1.71
Rot. Bonds4

About N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride

N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride (PubChem CID 119557894) has the molecular formula C12H23ClN2O and a molecular weight of 246.78 g/mol. Its IUPAC name is N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride
PubChem CID119557894
Molecular FormulaC12H23ClN2O
Molecular Weight246.78 g/mol
Exact Mass246.15
IUPAC NameN-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride
SMILESCl.O=C(NCCC1CCCNC1)C1CCC1
InChIInChI=1S/C12H22N2O.ClH/c15-12(11-4-1-5-11)14-8-6-10-3-2-7-13-9-10;/h10-11,13H,1-9H2,(H,14,15);1H
InChIKeyWROXDRQWMJLSJF-UHFFFAOYSA-N
XLogP1.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.78
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide
CID 60894096
N-(2-pyrrolidin-3-ylethyl)cycloheptanecarboxamide;hydrochloride
CID 119537193
N-(2-piperidin-3-ylethyl)bicyclo[3.1.0]hexane-6-carboxamide;hydrochloride
CID 119556041
N-(2-piperidin-3-ylethyl)bicyclo[3.1.0]hexane-6-carboxamide
CID 81479536
4-phenyl-N-(2-piperidin-3-ylethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119557227
N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride
CID 119260134
1-acetyl-N-(2-piperidin-3-ylethyl)piperidine-3-carboxamide
CID 119555744
N-(3-cyclohexylpropyl)piperidine-3-carboxamide;hydrochloride
CID 119289858
N-(2-cyclopentylethyl)cyclopentanecarboxamide
CID 110874283
N-[[(3R)-piperidin-3-yl]methyl]cycloheptanecarboxamide
CID 94502290
N-(piperidin-3-ylmethyl)cyclohexanecarboxamide
CID 18069614
2-cycloheptyl-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119557821

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride?
The IUPAC name of N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride (CID 119557894) is N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride.
What is the SMILES notation for N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride?
The canonical SMILES for N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride is Cl.O=C(NCCC1CCCNC1)C1CCC1.
What is the InChIKey of N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride?
The InChIKey is WROXDRQWMJLSJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O.ClH/c15-12(11-4-1-5-11)14-8-6-10-3-2-7-13-9-10;/h10-11,13H,1-9H2,(H,14,15);1H.
What are the key properties of N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride?
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride has a molecular weight of 246.78 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride is sourced from PubChem (CID 119557894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).