2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid

C12H20N2O3 — CID 61159569

IUPAC2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid
SMILESO=C(O)CN(C(=O)C1CCCN1)C1CCCC1
InChIInChI=1S/C12H20N2O3/c15-11(16)8-14(9-4-1-2-5-9)12(17)10-6-3-7-13-10/h9-10,13H,1-8H2,(H,15,16)
InChIKeyKUSSRZKAUGMDLG-UHFFFAOYSA-N
MW240.30 g/mol
LogP0.59
Rot. Bonds4

About 2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid

2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid (PubChem CID 61159569) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is 2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid
PubChem CID61159569
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid
SMILESO=C(O)CN(C(=O)C1CCCN1)C1CCCC1
InChIInChI=1S/C12H20N2O3/c15-11(16)8-14(9-4-1-2-5-9)12(17)10-6-3-7-13-10/h9-10,13H,1-8H2,(H,15,16)
InChIKeyKUSSRZKAUGMDLG-UHFFFAOYSA-N
XLogP0.59
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclopentyl(piperidine-2-carbonyl)amino]acetic acid
CID 61159763
2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid
CID 104913615
(2R)-N-(2-amino-2-oxoethyl)-N-cyclopentylpyrrolidine-2-carboxamide
CID 93372174
(2R)-N-cyclopentyl-N-(2-hydroxyethyl)piperidine-2-carboxamide
CID 104913462
2-[cyclopentyl(pyrrolidine-3-carbonyl)amino]acetic acid
CID 63005463
(2R)-N-cyclopropyl-N-(cyclopropylmethyl)pyrrolidine-2-carboxamide
CID 103796354
2-[propyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid
CID 103869567
2-[propan-2-yl(pyrrolidine-2-carbonyl)amino]acetic acid
CID 61159901
2-[ethyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid
CID 104913780
(2S)-N-(2-cyanoethyl)-N-cyclopropylpyrrolidine-2-carboxamide
CID 61157251
(2S)-N-butyl-N-cyclopropylpiperidine-2-carboxamide
CID 104913351
2-[cyclopentyl-(5-oxopiperazine-2-carbonyl)amino]acetic acid
CID 107435593

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid?
The IUPAC name of 2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid (CID 61159569) is 2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid is O=C(O)CN(C(=O)C1CCCN1)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid?
The InChIKey is KUSSRZKAUGMDLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c15-11(16)8-14(9-4-1-2-5-9)12(17)10-6-3-7-13-10/h9-10,13H,1-8H2,(H,15,16).
What are the key properties of 2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid?
2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid has a molecular weight of 240.30 g/mol, XLogP of 0.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(pyrrolidine-2-carbonyl)amino]acetic acid is sourced from PubChem (CID 61159569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).