4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide

C14H27N3O2 — CID 63824782

IUPAC4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(NCCOC2CCCCC2)CC1
InChIInChI=1S/C14H27N3O2/c15-14(18)17-9-6-12(7-10-17)16-8-11-19-13-4-2-1-3-5-13/h12-13,16H,1-11H2,(H2,15,18)
InChIKeyZGRHOUDPKAQNML-UHFFFAOYSA-N
MW269.39 g/mol
LogP1.47
Rot. Bonds5

About 4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide

4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide (PubChem CID 63824782) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide
PubChem CID63824782
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(NCCOC2CCCCC2)CC1
InChIInChI=1S/C14H27N3O2/c15-14(18)17-9-6-12(7-10-17)16-8-11-19-13-4-2-1-3-5-13/h12-13,16H,1-11H2,(H2,15,18)
InChIKeyZGRHOUDPKAQNML-UHFFFAOYSA-N
XLogP1.47
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 51.47
H-Bond Donors ≤ 52
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 4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide?
The IUPAC name of 4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide (CID 63824782) is 4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide.
What is the SMILES notation for 4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide?
The canonical SMILES for 4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide is NC(=O)N1CCC(NCCOC2CCCCC2)CC1.
What is the InChIKey of 4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide?
The InChIKey is ZGRHOUDPKAQNML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c15-14(18)17-9-6-12(7-10-17)16-8-11-19-13-4-2-1-3-5-13/h12-13,16H,1-11H2,(H2,15,18).
What are the key properties of 4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide?
4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 1.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclohexyloxyethylamino)piperidine-1-carboxamide is sourced from PubChem (CID 63824782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).