N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide

C14H26N2O — CID 115870643

IUPACN-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide
SMILESO=C(CCC1CCNCC1)NCCC1CCC1
InChIInChI=1S/C14H26N2O/c17-14(16-11-8-12-2-1-3-12)5-4-13-6-9-15-10-7-13/h12-13,15H,1-11H2,(H,16,17)
InChIKeyDAWOFLLQTCWZOJ-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.07
Rot. Bonds6

About N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide

N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide (PubChem CID 115870643) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide
PubChem CID115870643
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide
SMILESO=C(CCC1CCNCC1)NCCC1CCC1
InChIInChI=1S/C14H26N2O/c17-14(16-11-8-12-2-1-3-12)5-4-13-6-9-15-10-7-13/h12-13,15H,1-11H2,(H,16,17)
InChIKeyDAWOFLLQTCWZOJ-UHFFFAOYSA-N
XLogP2.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide?
The IUPAC name of N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide (CID 115870643) is N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide is O=C(CCC1CCNCC1)NCCC1CCC1.
What is the InChIKey of N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide?
The InChIKey is DAWOFLLQTCWZOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c17-14(16-11-8-12-2-1-3-12)5-4-13-6-9-15-10-7-13/h12-13,15H,1-11H2,(H,16,17).
What are the key properties of N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide?
N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide has a molecular weight of 238.37 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 115870643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).