2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid

C11H20N2O4S — CID 54925873

IUPAC2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid
SMILESO=C(O)CN(C1CCCC1)S(=O)(=O)N1CCCC1
InChIInChI=1S/C11H20N2O4S/c14-11(15)9-13(10-5-1-2-6-10)18(16,17)12-7-3-4-8-12/h10H,1-9H2,(H,14,15)
InChIKeyLZEGKTFMNFOVGA-UHFFFAOYSA-N
MW276.36 g/mol
LogP0.66
Rot. Bonds5

About 2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid

2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid (PubChem CID 54925873) has the molecular formula C11H20N2O4S and a molecular weight of 276.36 g/mol. Its IUPAC name is 2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid
PubChem CID54925873
Molecular FormulaC11H20N2O4S
Molecular Weight276.36 g/mol
Exact Mass276.11
IUPAC Name2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid
SMILESO=C(O)CN(C1CCCC1)S(=O)(=O)N1CCCC1
InChIInChI=1S/C11H20N2O4S/c14-11(15)9-13(10-5-1-2-6-10)18(16,17)12-7-3-4-8-12/h10H,1-9H2,(H,14,15)
InChIKeyLZEGKTFMNFOVGA-UHFFFAOYSA-N
XLogP0.66
TPSA77.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclopentyl(morpholin-4-ylsulfonyl)amino]acetic acid
CID 54925872
2-[(1,1-dioxothiolan-3-yl)-piperidin-1-ylsulfonylamino]acetic acid
CID 60829293
3-[cyclopropyl(piperidin-1-ylsulfonyl)amino]propanoic acid
CID 60830000
2-[cyclopentyl(piperidin-1-ylsulfonyl)amino]-N'-hydroxyethanimidamide
CID 77044834
N-(2-chloroethyl)-N-cyclohexylpyrrolidine-1-sulfonamide
CID 63396430
N-(2-aminoethyl)-N-cyclopentylpyrrolidine-1-sulfonamide
CID 63766567
N-(2-chloroethyl)-N-cyclohexylazepane-1-sulfonamide
CID 63396474
2-[azepan-1-ylsulfonyl(piperidin-4-yl)amino]acetamide
CID 60801061
2-[cyclopentyl(trifluoromethylsulfonyl)amino]acetic acid
CID 60828301
N-(2-bromoethyl)-N-cyclobutylpyrrolidine-1-sulfonamide
CID 102873540
2-[cyclohexyl(ethylsulfonyl)amino]acetic acid
CID 50849243
2-[cyclopropyl-(2,6-dimethylmorpholin-4-yl)sulfonylamino]acetic acid
CID 54945247

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid?
The IUPAC name of 2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid (CID 54925873) is 2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid?
The canonical SMILES for 2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid is O=C(O)CN(C1CCCC1)S(=O)(=O)N1CCCC1.
What is the InChIKey of 2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid?
The InChIKey is LZEGKTFMNFOVGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O4S/c14-11(15)9-13(10-5-1-2-6-10)18(16,17)12-7-3-4-8-12/h10H,1-9H2,(H,14,15).
What are the key properties of 2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid?
2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid has a molecular weight of 276.36 g/mol, XLogP of 0.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(pyrrolidin-1-ylsulfonyl)amino]acetic acid is sourced from PubChem (CID 54925873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).