4-cyclohexyloxy-2-(propylamino)butanamide

C13H26N2O2 — CID 63039498

IUPAC4-cyclohexyloxy-2-(propylamino)butanamide
SMILESCCCNC(CCOC1CCCCC1)C(N)=O
InChIInChI=1S/C13H26N2O2/c1-2-9-15-12(13(14)16)8-10-17-11-6-4-3-5-7-11/h11-12,15H,2-10H2,1H3,(H2,14,16)
InChIKeyARFZUWPCVHLSSF-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.58
Rot. Bonds8

About 4-cyclohexyloxy-2-(propylamino)butanamide

4-cyclohexyloxy-2-(propylamino)butanamide (PubChem CID 63039498) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 4-cyclohexyloxy-2-(propylamino)butanamide.

Molecular Properties

Compound Name4-cyclohexyloxy-2-(propylamino)butanamide
PubChem CID63039498
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name4-cyclohexyloxy-2-(propylamino)butanamide
SMILESCCCNC(CCOC1CCCCC1)C(N)=O
InChIInChI=1S/C13H26N2O2/c1-2-9-15-12(13(14)16)8-10-17-11-6-4-3-5-7-11/h11-12,15H,2-10H2,1H3,(H2,14,16)
InChIKeyARFZUWPCVHLSSF-UHFFFAOYSA-N
XLogP1.58
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyloxy-2-(propylamino)butanamide?
The IUPAC name of 4-cyclohexyloxy-2-(propylamino)butanamide (CID 63039498) is 4-cyclohexyloxy-2-(propylamino)butanamide.
What is the SMILES notation for 4-cyclohexyloxy-2-(propylamino)butanamide?
The canonical SMILES for 4-cyclohexyloxy-2-(propylamino)butanamide is CCCNC(CCOC1CCCCC1)C(N)=O.
What is the InChIKey of 4-cyclohexyloxy-2-(propylamino)butanamide?
The InChIKey is ARFZUWPCVHLSSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-2-9-15-12(13(14)16)8-10-17-11-6-4-3-5-7-11/h11-12,15H,2-10H2,1H3,(H2,14,16).
What are the key properties of 4-cyclohexyloxy-2-(propylamino)butanamide?
4-cyclohexyloxy-2-(propylamino)butanamide has a molecular weight of 242.36 g/mol, XLogP of 1.58, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyloxy-2-(propylamino)butanamide is sourced from PubChem (CID 63039498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).