2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide

C15H26N2O3 — CID 71918748

IUPAC2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
SMILESCCC(OC1CCCCC1)C(=O)NC1CC(=O)N(C)C1
InChIInChI=1S/C15H26N2O3/c1-3-13(20-12-7-5-4-6-8-12)15(19)16-11-9-14(18)17(2)10-11/h11-13H,3-10H2,1-2H3,(H,16,19)
InChIKeyLOOAFEBQQZPFBM-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.46
Rot. Bonds5

About 2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide

2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide (PubChem CID 71918748) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide.

Molecular Properties

Compound Name2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
PubChem CID71918748
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
SMILESCCC(OC1CCCCC1)C(=O)NC1CC(=O)N(C)C1
InChIInChI=1S/C15H26N2O3/c1-3-13(20-12-7-5-4-6-8-12)15(19)16-11-9-14(18)17(2)10-11/h11-13H,3-10H2,1-2H3,(H,16,19)
InChIKeyLOOAFEBQQZPFBM-UHFFFAOYSA-N
XLogP1.46
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide?
The IUPAC name of 2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide (CID 71918748) is 2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide.
What is the SMILES notation for 2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide?
The canonical SMILES for 2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide is CCC(OC1CCCCC1)C(=O)NC1CC(=O)N(C)C1.
What is the InChIKey of 2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide?
The InChIKey is LOOAFEBQQZPFBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-3-13(20-12-7-5-4-6-8-12)15(19)16-11-9-14(18)17(2)10-11/h11-13H,3-10H2,1-2H3,(H,16,19).
What are the key properties of 2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide?
2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide has a molecular weight of 282.38 g/mol, XLogP of 1.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide is sourced from PubChem (CID 71918748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).