2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid

C13H22N2O3 — CID 104913615

IUPAC2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid
SMILESO=C(O)CN(C(=O)[C@H]1CCCCN1)C1CCCC1
InChIInChI=1S/C13H22N2O3/c16-12(17)9-15(10-5-1-2-6-10)13(18)11-7-3-4-8-14-11/h10-11,14H,1-9H2,(H,16,17)/t11-/m1/s1
InChIKeyQNEYMAOSXDBACI-LLVKDONJSA-N
MW254.33 g/mol
LogP0.98
Rot. Bonds4

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

2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid (PubChem CID 104913615) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid
PubChem CID104913615
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC Name2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid
SMILESO=C(O)CN(C(=O)[C@H]1CCCCN1)C1CCCC1
InChIInChI=1S/C13H22N2O3/c16-12(17)9-15(10-5-1-2-6-10)13(18)11-7-3-4-8-14-11/h10-11,14H,1-9H2,(H,16,17)/t11-/m1/s1
InChIKeyQNEYMAOSXDBACI-LLVKDONJSA-N
XLogP0.98
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 50.98
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(pyrrolidine-2-carbonyl)amino]acetic acid
CID 61159569
(2R)-N-cyclopentyl-N-(2-hydroxyethyl)piperidine-2-carboxamide
CID 104913462
(2R)-N-(2-amino-2-oxoethyl)-N-cyclopentylpyrrolidine-2-carboxamide
CID 93372174
2-[ethyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid
CID 104913780
(2S)-N-butyl-N-cyclopropylpiperidine-2-carboxamide
CID 104913351
2-[cyclopentyl(pyrrolidine-3-carbonyl)amino]acetic acid
CID 63005463
(2S)-N-cyclopropyl-N-(3-methylbutyl)piperidine-2-carboxamide
CID 93369841
N-(2-cyanoethyl)-N-cyclopropylazepane-2-carboxamide
CID 64563457
N-benzyl-N-cyclopropylpiperidine-2-carboxamide
CID 43579225
2-[cyclopentyl-(5-oxopiperazine-2-carbonyl)amino]acetic acid
CID 107435593
2-[cyclopropyl(1,3-thiazolidine-4-carbonyl)amino]acetic acid
CID 61161099

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid?
The IUPAC name of 2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid (CID 104913615) is 2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid?
The canonical SMILES for 2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid is O=C(O)CN(C(=O)[C@H]1CCCCN1)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid?
The InChIKey is QNEYMAOSXDBACI-LLVKDONJSA-N. The full InChI is InChI=1S/C13H22N2O3/c16-12(17)9-15(10-5-1-2-6-10)13(18)11-7-3-4-8-14-11/h10-11,14H,1-9H2,(H,16,17)/t11-/m1/s1.
What are the key properties of 2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid?
2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid has a molecular weight of 254.33 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid is sourced from PubChem (CID 104913615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).