2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide

C18H30N2O3 — CID 86769756

IUPAC2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide
SMILESCC(C)(C(=O)NC1CCN(C2CCOCC2)C1=O)C1CCCC1
InChIInChI=1S/C18H30N2O3/c1-18(2,13-5-3-4-6-13)17(22)19-15-7-10-20(16(15)21)14-8-11-23-12-9-14/h13-15H,3-12H2,1-2H3,(H,19,22)
InChIKeyHRELDVUKFKIANA-UHFFFAOYSA-N
MW322.45 g/mol
LogP2.10
Rot. Bonds4

About 2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide

2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide (PubChem CID 86769756) has the molecular formula C18H30N2O3 and a molecular weight of 322.45 g/mol. Its IUPAC name is 2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide.

Molecular Properties

Compound Name2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide
PubChem CID86769756
Molecular FormulaC18H30N2O3
Molecular Weight322.45 g/mol
Exact Mass322.23
IUPAC Name2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide
SMILESCC(C)(C(=O)NC1CCN(C2CCOCC2)C1=O)C1CCCC1
InChIInChI=1S/C18H30N2O3/c1-18(2,13-5-3-4-6-13)17(22)19-15-7-10-20(16(15)21)14-8-11-23-12-9-14/h13-15H,3-12H2,1-2H3,(H,19,22)
InChIKeyHRELDVUKFKIANA-UHFFFAOYSA-N
XLogP2.10
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide?
The IUPAC name of 2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide (CID 86769756) is 2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide.
What is the SMILES notation for 2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide?
The canonical SMILES for 2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide is CC(C)(C(=O)NC1CCN(C2CCOCC2)C1=O)C1CCCC1.
What is the InChIKey of 2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide?
The InChIKey is HRELDVUKFKIANA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O3/c1-18(2,13-5-3-4-6-13)17(22)19-15-7-10-20(16(15)21)14-8-11-23-12-9-14/h13-15H,3-12H2,1-2H3,(H,19,22).
What are the key properties of 2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide?
2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide has a molecular weight of 322.45 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-methyl-N-[1-(oxan-4-yl)-2-oxopyrrolidin-3-yl]propanamide is sourced from PubChem (CID 86769756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).