N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide

C13H24N2O — CID 17250181

IUPACN-(1-propylpiperidin-4-yl)cyclobutanecarboxamide
SMILESCCCN1CCC(NC(=O)C2CCC2)CC1
InChIInChI=1S/C13H24N2O/c1-2-8-15-9-6-12(7-10-15)14-13(16)11-4-3-5-11/h11-12H,2-10H2,1H3,(H,14,16)
InChIKeyJQFHAOZZHFLRCS-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.78
Rot. Bonds4

About N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide

N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide (PubChem CID 17250181) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide.

Molecular Properties

Compound NameN-(1-propylpiperidin-4-yl)cyclobutanecarboxamide
PubChem CID17250181
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-(1-propylpiperidin-4-yl)cyclobutanecarboxamide
SMILESCCCN1CCC(NC(=O)C2CCC2)CC1
InChIInChI=1S/C13H24N2O/c1-2-8-15-9-6-12(7-10-15)14-13(16)11-4-3-5-11/h11-12H,2-10H2,1H3,(H,14,16)
InChIKeyJQFHAOZZHFLRCS-UHFFFAOYSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide?
The IUPAC name of N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide (CID 17250181) is N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide.
What is the SMILES notation for N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide?
The canonical SMILES for N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide is CCCN1CCC(NC(=O)C2CCC2)CC1.
What is the InChIKey of N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide?
The InChIKey is JQFHAOZZHFLRCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-2-8-15-9-6-12(7-10-15)14-13(16)11-4-3-5-11/h11-12H,2-10H2,1H3,(H,14,16).
What are the key properties of N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide?
N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide has a molecular weight of 224.35 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-propylpiperidin-4-yl)cyclobutanecarboxamide is sourced from PubChem (CID 17250181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).