methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate

C15H26N2O3 — CID 126707470

IUPACmethyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate
SMILESCC[C@@H]1CCCN1C(=O)C(NC(=O)OC)C1CCCC1
InChIInChI=1S/C15H26N2O3/c1-3-12-9-6-10-17(12)14(18)13(16-15(19)20-2)11-7-4-5-8-11/h11-13H,3-10H2,1-2H3,(H,16,19)/t12-,13?/m1/s1
InChIKeyRITTYAYUTHGJBO-PZORYLMUSA-N
MW282.38 g/mol
LogP2.30
Rot. Bonds4

About methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate

methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate (PubChem CID 126707470) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate.

Molecular Properties

Compound Namemethyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate
PubChem CID126707470
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Namemethyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate
SMILESCC[C@@H]1CCCN1C(=O)C(NC(=O)OC)C1CCCC1
InChIInChI=1S/C15H26N2O3/c1-3-12-9-6-10-17(12)14(18)13(16-15(19)20-2)11-7-4-5-8-11/h11-13H,3-10H2,1-2H3,(H,16,19)/t12-,13?/m1/s1
InChIKeyRITTYAYUTHGJBO-PZORYLMUSA-N
XLogP2.30
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate?
The IUPAC name of methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate (CID 126707470) is methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate.
What is the SMILES notation for methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate?
The canonical SMILES for methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate is CC[C@@H]1CCCN1C(=O)C(NC(=O)OC)C1CCCC1.
What is the InChIKey of methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate?
The InChIKey is RITTYAYUTHGJBO-PZORYLMUSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-3-12-9-6-10-17(12)14(18)13(16-15(19)20-2)11-7-4-5-8-11/h11-13H,3-10H2,1-2H3,(H,16,19)/t12-,13?/m1/s1.
What are the key properties of methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate?
methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate has a molecular weight of 282.38 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[1-cyclopentyl-2-[(2R)-2-ethylpyrrolidin-1-yl]-2-oxoethyl]carbamate is sourced from PubChem (CID 126707470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).