N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide

C16H24N2O4S — CID 38370943

IUPACN-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide
SMILESO=C(CN(Cc1ccco1)[C@H]1CCS(=O)(=O)C1)NC1CCCC1
InChIInChI=1S/C16H24N2O4S/c19-16(17-13-4-1-2-5-13)11-18(10-15-6-3-8-22-15)14-7-9-23(20,21)12-14/h3,6,8,13-14H,1-2,4-5,7,9-12H2,(H,17,19)/t14-/m0/s1
InChIKeyZDAKXOZRWAVSIK-AWEZNQCLSA-N
MW340.45 g/mol
LogP1.33
Rot. Bonds6

About N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide

N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide (PubChem CID 38370943) has the molecular formula C16H24N2O4S and a molecular weight of 340.45 g/mol. Its IUPAC name is N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide
PubChem CID38370943
Molecular FormulaC16H24N2O4S
Molecular Weight340.45 g/mol
Exact Mass340.15
IUPAC NameN-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide
SMILESO=C(CN(Cc1ccco1)[C@H]1CCS(=O)(=O)C1)NC1CCCC1
InChIInChI=1S/C16H24N2O4S/c19-16(17-13-4-1-2-5-13)11-18(10-15-6-3-8-22-15)14-7-9-23(20,21)12-14/h3,6,8,13-14H,1-2,4-5,7,9-12H2,(H,17,19)/t14-/m0/s1
InChIKeyZDAKXOZRWAVSIK-AWEZNQCLSA-N
XLogP1.33
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]-N-(methylcarbamoyl)acetamide
CID 94016788
2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide
CID 25479249
2-[(1,1-dioxothiolan-3-yl)-(furan-2-ylmethyl)amino]-N-(1-phenylethyl)acetamide
CID 18142864
2-[bis(furan-2-ylmethyl)amino]-N-cycloheptylacetamide
CID 27118894
2-[(1,1-dioxothiolan-3-yl)-(furan-2-ylmethyl)amino]-N-(2-phenylpropyl)acetamide
CID 18142870
N-(1,1-dioxothiolan-3-yl)-N-(furan-2-ylmethyl)cyclohexanecarboxamide
CID 102565822
2-[(1,1-dioxothiolan-3-yl)-(furan-2-ylmethyl)amino]-N-(4-methyl-2-nitrophenyl)acetamide
CID 42921555
2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide
CID 113161038
N-[(3R)-1,1-dioxothiolan-3-yl]-N-(furan-2-ylmethyl)benzamide
CID 7546676
N-cyclopentyl-2-[furan-2-ylmethyl(methylsulfonyl)amino]acetamide
CID 113150243
N-cyclopentyl-2-(furan-2-yl)acetamide
CID 110690587
N-[(3S)-1,1-dioxothiolan-3-yl]-N-(furan-2-ylmethyl)formamide
CID 99976891

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide?
The IUPAC name of N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide (CID 38370943) is N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide is O=C(CN(Cc1ccco1)[C@H]1CCS(=O)(=O)C1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide?
The InChIKey is ZDAKXOZRWAVSIK-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H24N2O4S/c19-16(17-13-4-1-2-5-13)11-18(10-15-6-3-8-22-15)14-7-9-23(20,21)12-14/h3,6,8,13-14H,1-2,4-5,7,9-12H2,(H,17,19)/t14-/m0/s1.
What are the key properties of N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide?
N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide has a molecular weight of 340.45 g/mol, XLogP of 1.33, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]acetamide is sourced from PubChem (CID 38370943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).