N-hexylmorpholine-4-carboxamide

C11H22N2O2 — CID 4626364

IUPACN-hexylmorpholine-4-carboxamide
SMILESCCCCCCNC(=O)N1CCOCC1
InChIInChI=1S/C11H22N2O2/c1-2-3-4-5-6-12-11(14)13-7-9-15-10-8-13/h2-10H2,1H3,(H,12,14)
InChIKeyXIFXDLRLKUNITJ-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.61
Rot. Bonds5

About N-hexylmorpholine-4-carboxamide

N-hexylmorpholine-4-carboxamide (PubChem CID 4626364) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-hexylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-hexylmorpholine-4-carboxamide
PubChem CID4626364
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-hexylmorpholine-4-carboxamide
SMILESCCCCCCNC(=O)N1CCOCC1
InChIInChI=1S/C11H22N2O2/c1-2-3-4-5-6-12-11(14)13-7-9-15-10-8-13/h2-10H2,1H3,(H,12,14)
InChIKeyXIFXDLRLKUNITJ-UHFFFAOYSA-N
XLogP1.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.61
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-hexylmorpholine-4-carboxamide?
The IUPAC name of N-hexylmorpholine-4-carboxamide (CID 4626364) is N-hexylmorpholine-4-carboxamide.
What is the SMILES notation for N-hexylmorpholine-4-carboxamide?
The canonical SMILES for N-hexylmorpholine-4-carboxamide is CCCCCCNC(=O)N1CCOCC1.
What is the InChIKey of N-hexylmorpholine-4-carboxamide?
The InChIKey is XIFXDLRLKUNITJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-2-3-4-5-6-12-11(14)13-7-9-15-10-8-13/h2-10H2,1H3,(H,12,14).
What are the key properties of N-hexylmorpholine-4-carboxamide?
N-hexylmorpholine-4-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 1.61, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexylmorpholine-4-carboxamide is sourced from PubChem (CID 4626364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).