N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide

C13H21NO — CID 4063617

IUPACN-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide
SMILESO=C(NC1CCCC1)C1CC2CCC1C2
InChIInChI=1S/C13H21NO/c15-13(14-11-3-1-2-4-11)12-8-9-5-6-10(12)7-9/h9-12H,1-8H2,(H,14,15)
InChIKeyQILTXGAQJHOBPF-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.48
Rot. Bonds2

About N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide

N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide (PubChem CID 4063617) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide
PubChem CID4063617
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC NameN-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide
SMILESO=C(NC1CCCC1)C1CC2CCC1C2
InChIInChI=1S/C13H21NO/c15-13(14-11-3-1-2-4-11)12-8-9-5-6-10(12)7-9/h9-12H,1-8H2,(H,14,15)
InChIKeyQILTXGAQJHOBPF-UHFFFAOYSA-N
XLogP2.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide?
The IUPAC name of N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide (CID 4063617) is N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide.
What is the SMILES notation for N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide?
The canonical SMILES for N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide is O=C(NC1CCCC1)C1CC2CCC1C2.
What is the InChIKey of N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide?
The InChIKey is QILTXGAQJHOBPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c15-13(14-11-3-1-2-4-11)12-8-9-5-6-10(12)7-9/h9-12H,1-8H2,(H,14,15).
What are the key properties of N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide?
N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide has a molecular weight of 207.32 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentylbicyclo[2.2.1]heptane-2-carboxamide is sourced from PubChem (CID 4063617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).