1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid

C15H26N2O3 — CID 114431254

IUPAC1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid
SMILESCCC1CCN(CC(=O)NC2CCCC2)C(C(=O)O)C1
InChIInChI=1S/C15H26N2O3/c1-2-11-7-8-17(13(9-11)15(19)20)10-14(18)16-12-5-3-4-6-12/h11-13H,2-10H2,1H3,(H,16,18)(H,19,20)
InChIKeyKUOGDKZBLSTFTC-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.62
Rot. Bonds5

About 1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid

1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid (PubChem CID 114431254) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid.

Molecular Properties

Compound Name1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid
PubChem CID114431254
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid
SMILESCCC1CCN(CC(=O)NC2CCCC2)C(C(=O)O)C1
InChIInChI=1S/C15H26N2O3/c1-2-11-7-8-17(13(9-11)15(19)20)10-14(18)16-12-5-3-4-6-12/h11-13H,2-10H2,1H3,(H,16,18)(H,19,20)
InChIKeyKUOGDKZBLSTFTC-UHFFFAOYSA-N
XLogP1.62
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopentylmethyl)-4-ethylpiperidine-2-carboxylic acid
CID 114431174
4-ethyl-1-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]piperidine-2-carboxylic acid
CID 114431846
4-ethyl-1-[3-oxo-3-(propan-2-ylamino)propyl]piperidine-2-carboxylic acid
CID 114430884
1-[2-(dimethylamino)ethyl]-4-ethylpiperidine-2-carboxylic acid
CID 114431248
1-(cyclopropylcarbamoyl)-4-ethylpiperidine-2-carboxylic acid
CID 114427375
4-ethyl-1-(2-methylpropyl)piperidine-2-carboxylic acid
CID 114430632
4-ethyl-1-(4-hydroxybutyl)piperidine-2-carboxylic acid
CID 114431447
4-ethyl-1-[2-[(3-methyl-1,2-oxazol-5-yl)amino]-2-oxoethyl]piperidine-2-carboxylic acid
CID 114430623
ethyl 1-[2-(cycloheptylamino)-2-oxoethyl]pyrrolidine-2-carboxylate
CID 62028753
4-ethyl-1-(3-methoxypropyl)piperidine-2-carboxylic acid
CID 114431008
4-ethyl-1-[(3-methylcyclobutyl)carbamoyl]piperidine-2-carboxylic acid
CID 114430520
4-ethyl-1-pent-4-enylpiperidine-2-carboxylic acid
CID 114431232

Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid?
The IUPAC name of 1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid (CID 114431254) is 1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid.
What is the SMILES notation for 1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid?
The canonical SMILES for 1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid is CCC1CCN(CC(=O)NC2CCCC2)C(C(=O)O)C1.
What is the InChIKey of 1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid?
The InChIKey is KUOGDKZBLSTFTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-2-11-7-8-17(13(9-11)15(19)20)10-14(18)16-12-5-3-4-6-12/h11-13H,2-10H2,1H3,(H,16,18)(H,19,20).
What are the key properties of 1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid?
1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid has a molecular weight of 282.38 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-2-carboxylic acid is sourced from PubChem (CID 114431254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).