N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide

C15H25NO — CID 541723

IUPACN-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide
SMILESCC(NC(=O)C1CCCC1)C1CC2CCC1C2
InChIInChI=1S/C15H25NO/c1-10(14-9-11-6-7-13(14)8-11)16-15(17)12-4-2-3-5-12/h10-14H,2-9H2,1H3,(H,16,17)
InChIKeyVEPVIDPICCSUMS-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.12
Rot. Bonds3

About N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide

N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide (PubChem CID 541723) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide
PubChem CID541723
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC NameN-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide
SMILESCC(NC(=O)C1CCCC1)C1CC2CCC1C2
InChIInChI=1S/C15H25NO/c1-10(14-9-11-6-7-13(14)8-11)16-15(17)12-4-2-3-5-12/h10-14H,2-9H2,1H3,(H,16,17)
InChIKeyVEPVIDPICCSUMS-UHFFFAOYSA-N
XLogP3.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide?
The IUPAC name of N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide (CID 541723) is N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide?
The canonical SMILES for N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide is CC(NC(=O)C1CCCC1)C1CC2CCC1C2.
What is the InChIKey of N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide?
The InChIKey is VEPVIDPICCSUMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-10(14-9-11-6-7-13(14)8-11)16-15(17)12-4-2-3-5-12/h10-14H,2-9H2,1H3,(H,16,17).
What are the key properties of N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide?
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide has a molecular weight of 235.37 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]cyclopentanecarboxamide is sourced from PubChem (CID 541723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).