3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide

C19H30N2O4S — CID 51953240

IUPAC3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide
SMILESO=C(CCS(=O)(=O)C1CCCC1)NC[C@H](c1ccco1)N1CCCCC1
InChIInChI=1S/C19H30N2O4S/c22-19(10-14-26(23,24)16-7-2-3-8-16)20-15-17(18-9-6-13-25-18)21-11-4-1-5-12-21/h6,9,13,16-17H,1-5,7-8,10-12,14-15H2,(H,20,22)/t17-/m1/s1
InChIKeyDAXYVNBMUZDRGV-QGZVFWFLSA-N
MW382.53 g/mol
LogP2.67
Rot. Bonds8

About 3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide

3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide (PubChem CID 51953240) has the molecular formula C19H30N2O4S and a molecular weight of 382.53 g/mol. Its IUPAC name is 3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide.

Molecular Properties

Compound Name3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide
PubChem CID51953240
Molecular FormulaC19H30N2O4S
Molecular Weight382.53 g/mol
Exact Mass382.19
IUPAC Name3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide
SMILESO=C(CCS(=O)(=O)C1CCCC1)NC[C@H](c1ccco1)N1CCCCC1
InChIInChI=1S/C19H30N2O4S/c22-19(10-14-26(23,24)16-7-2-3-8-16)20-15-17(18-9-6-13-25-18)21-11-4-1-5-12-21/h6,9,13,16-17H,1-5,7-8,10-12,14-15H2,(H,20,22)/t17-/m1/s1
InChIKeyDAXYVNBMUZDRGV-QGZVFWFLSA-N
XLogP2.67
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.53
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(azepan-1-yl)-2-(furan-2-yl)ethyl]butanamide
CID 112503325
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 60636600
N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 93157841
N-[2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-2-oxoethyl]cyclohexanecarboxamide
CID 18161471
3-[(3aS,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]propanamide
CID 11932186
4-chloro-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 55204450
N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopropanecarboxamide
CID 7780302
N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-phenylpropanamide
CID 7780304
3-acetamido-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]propanamide
CID 110353373
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-phenoxybutanamide
CID 51162656
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111430213
N-[4-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-4-oxobutyl]benzamide
CID 46522317

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide?
The IUPAC name of 3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide (CID 51953240) is 3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide.
What is the SMILES notation for 3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide?
The canonical SMILES for 3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide is O=C(CCS(=O)(=O)C1CCCC1)NC[C@H](c1ccco1)N1CCCCC1.
What is the InChIKey of 3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide?
The InChIKey is DAXYVNBMUZDRGV-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H30N2O4S/c22-19(10-14-26(23,24)16-7-2-3-8-16)20-15-17(18-9-6-13-25-18)21-11-4-1-5-12-21/h6,9,13,16-17H,1-5,7-8,10-12,14-15H2,(H,20,22)/t17-/m1/s1.
What are the key properties of 3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide?
3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide has a molecular weight of 382.53 g/mol, XLogP of 2.67, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentylsulfonyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]propanamide is sourced from PubChem (CID 51953240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).