N,N-dicyclohexyl-5-morpholin-4-ylpentanamide

C21H38N2O2 — CID 67746963

IUPACN,N-dicyclohexyl-5-morpholin-4-ylpentanamide
SMILESO=C(CCCCN1CCOCC1)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C21H38N2O2/c24-21(13-7-8-14-22-15-17-25-18-16-22)23(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h19-20H,1-18H2
InChIKeyWGFLCCCGQXZVFR-UHFFFAOYSA-N
MW350.55 g/mol
LogP3.98
Rot. Bonds7

About N,N-dicyclohexyl-5-morpholin-4-ylpentanamide

N,N-dicyclohexyl-5-morpholin-4-ylpentanamide (PubChem CID 67746963) has the molecular formula C21H38N2O2 and a molecular weight of 350.55 g/mol. Its IUPAC name is N,N-dicyclohexyl-5-morpholin-4-ylpentanamide.

Molecular Properties

Compound NameN,N-dicyclohexyl-5-morpholin-4-ylpentanamide
PubChem CID67746963
Molecular FormulaC21H38N2O2
Molecular Weight350.55 g/mol
Exact Mass350.29
IUPAC NameN,N-dicyclohexyl-5-morpholin-4-ylpentanamide
SMILESO=C(CCCCN1CCOCC1)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C21H38N2O2/c24-21(13-7-8-14-22-15-17-25-18-16-22)23(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h19-20H,1-18H2
InChIKeyWGFLCCCGQXZVFR-UHFFFAOYSA-N
XLogP3.98
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.55
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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,N-dicyclohexyl-5-morpholin-4-ylpentanamide?
The IUPAC name of N,N-dicyclohexyl-5-morpholin-4-ylpentanamide (CID 67746963) is N,N-dicyclohexyl-5-morpholin-4-ylpentanamide.
What is the SMILES notation for N,N-dicyclohexyl-5-morpholin-4-ylpentanamide?
The canonical SMILES for N,N-dicyclohexyl-5-morpholin-4-ylpentanamide is O=C(CCCCN1CCOCC1)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N,N-dicyclohexyl-5-morpholin-4-ylpentanamide?
The InChIKey is WGFLCCCGQXZVFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H38N2O2/c24-21(13-7-8-14-22-15-17-25-18-16-22)23(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h19-20H,1-18H2.
What are the key properties of N,N-dicyclohexyl-5-morpholin-4-ylpentanamide?
N,N-dicyclohexyl-5-morpholin-4-ylpentanamide has a molecular weight of 350.55 g/mol, XLogP of 3.98, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexyl-5-morpholin-4-ylpentanamide is sourced from PubChem (CID 67746963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).