N-(3-cyclopentylpropyl)morpholine-4-carboxamide

C13H24N2O2 — CID 54192307

IUPACN-(3-cyclopentylpropyl)morpholine-4-carboxamide
SMILESO=C(NCCCC1CCCC1)N1CCOCC1
InChIInChI=1S/C13H24N2O2/c16-13(15-8-10-17-11-9-15)14-7-3-6-12-4-1-2-5-12/h12H,1-11H2,(H,14,16)
InChIKeyNCEZIFHFTYSDPY-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.00
Rot. Bonds4

About N-(3-cyclopentylpropyl)morpholine-4-carboxamide

N-(3-cyclopentylpropyl)morpholine-4-carboxamide (PubChem CID 54192307) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-(3-cyclopentylpropyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(3-cyclopentylpropyl)morpholine-4-carboxamide
PubChem CID54192307
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-(3-cyclopentylpropyl)morpholine-4-carboxamide
SMILESO=C(NCCCC1CCCC1)N1CCOCC1
InChIInChI=1S/C13H24N2O2/c16-13(15-8-10-17-11-9-15)14-7-3-6-12-4-1-2-5-12/h12H,1-11H2,(H,14,16)
InChIKeyNCEZIFHFTYSDPY-UHFFFAOYSA-N
XLogP2.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentylpropyl)morpholine-4-carboxamide?
The IUPAC name of N-(3-cyclopentylpropyl)morpholine-4-carboxamide (CID 54192307) is N-(3-cyclopentylpropyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(3-cyclopentylpropyl)morpholine-4-carboxamide?
The canonical SMILES for N-(3-cyclopentylpropyl)morpholine-4-carboxamide is O=C(NCCCC1CCCC1)N1CCOCC1.
What is the InChIKey of N-(3-cyclopentylpropyl)morpholine-4-carboxamide?
The InChIKey is NCEZIFHFTYSDPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c16-13(15-8-10-17-11-9-15)14-7-3-6-12-4-1-2-5-12/h12H,1-11H2,(H,14,16).
What are the key properties of N-(3-cyclopentylpropyl)morpholine-4-carboxamide?
N-(3-cyclopentylpropyl)morpholine-4-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentylpropyl)morpholine-4-carboxamide is sourced from PubChem (CID 54192307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).