2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid

C15H26N2O3 — CID 61195643

IUPAC2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid
SMILESCCC1CCCCN1C(=O)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C15H26N2O3/c1-2-12-7-5-6-10-16(12)15(20)17(11-14(18)19)13-8-3-4-9-13/h12-13H,2-11H2,1H3,(H,18,19)
InChIKeyXGCXKJLRISBODN-UHFFFAOYSA-N
MW282.38 g/mol
LogP2.70
Rot. Bonds4

About 2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid

2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid (PubChem CID 61195643) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid
PubChem CID61195643
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid
SMILESCCC1CCCCN1C(=O)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C15H26N2O3/c1-2-12-7-5-6-10-16(12)15(20)17(11-14(18)19)13-8-3-4-9-13/h12-13H,2-11H2,1H3,(H,18,19)
InChIKeyXGCXKJLRISBODN-UHFFFAOYSA-N
XLogP2.70
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-ethylpiperidine-1-carbonyl)-methylamino]propanoic acid
CID 62637552
2-[butan-2-yl-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]amino]acetic acid
CID 60834213
2-[1-[butyl(cyclopropyl)carbamoyl]piperidin-2-yl]acetic acid
CID 61443667
2-[cyclopentyl-(3-ethylpiperidine-1-carbonyl)amino]acetic acid
CID 61200673
2-[propyl-(2-propylpiperidine-1-carbonyl)amino]acetic acid
CID 83055974
4-(2-ethylazepan-1-yl)-4-oxobutanoic acid
CID 115910484
1-(2-ethylazepan-1-yl)ethanone
CID 115642380
1-[(2R)-2-ethylpiperidin-1-yl]propan-1-one
CID 40538705
(2R)-2-[[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]-methylamino]propanoic acid
CID 124834654
N-cyclopentyl-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide
CID 113148905
2-[butan-2-yl-[2-(hydroxymethyl)piperidine-1-carbonyl]amino]acetic acid
CID 61407553
6-(2-ethylpiperidin-1-yl)-6-oxohexanoic acid
CID 43447225

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid?
The IUPAC name of 2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid (CID 61195643) is 2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid is CCC1CCCCN1C(=O)N(CC(=O)O)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid?
The InChIKey is XGCXKJLRISBODN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-2-12-7-5-6-10-16(12)15(20)17(11-14(18)19)13-8-3-4-9-13/h12-13H,2-11H2,1H3,(H,18,19).
What are the key properties of 2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid?
2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid has a molecular weight of 282.38 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-(2-ethylpiperidine-1-carbonyl)amino]acetic acid is sourced from PubChem (CID 61195643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).