1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide

C14H24N2O3S — CID 164640214

IUPAC1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide
SMILESO=C1C[C@H](CNS(=O)(=O)CC2CCCC2)CN1C1CC1
InChIInChI=1S/C14H24N2O3S/c17-14-7-12(9-16(14)13-5-6-13)8-15-20(18,19)10-11-3-1-2-4-11/h11-13,15H,1-10H2/t12-/m1/s1
InChIKeyCPMDFRBQHXMCML-GFCCVEGCSA-N
MW300.42 g/mol
LogP1.11
Rot. Bonds6

About 1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide

1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide (PubChem CID 164640214) has the molecular formula C14H24N2O3S and a molecular weight of 300.42 g/mol. Its IUPAC name is 1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide.

Molecular Properties

Compound Name1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide
PubChem CID164640214
Molecular FormulaC14H24N2O3S
Molecular Weight300.42 g/mol
Exact Mass300.15
IUPAC Name1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide
SMILESO=C1C[C@H](CNS(=O)(=O)CC2CCCC2)CN1C1CC1
InChIInChI=1S/C14H24N2O3S/c17-14-7-12(9-16(14)13-5-6-13)8-15-20(18,19)10-11-3-1-2-4-11/h11-13,15H,1-10H2/t12-/m1/s1
InChIKeyCPMDFRBQHXMCML-GFCCVEGCSA-N
XLogP1.11
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.42
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide?
The IUPAC name of 1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide (CID 164640214) is 1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide.
What is the SMILES notation for 1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide?
The canonical SMILES for 1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide is O=C1C[C@H](CNS(=O)(=O)CC2CCCC2)CN1C1CC1.
What is the InChIKey of 1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide?
The InChIKey is CPMDFRBQHXMCML-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H24N2O3S/c17-14-7-12(9-16(14)13-5-6-13)8-15-20(18,19)10-11-3-1-2-4-11/h11-13,15H,1-10H2/t12-/m1/s1.
What are the key properties of 1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide?
1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide has a molecular weight of 300.42 g/mol, XLogP of 1.11, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]methyl]methanesulfonamide is sourced from PubChem (CID 164640214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).