1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid

C10H18N2O3 — CID 39243400

IUPAC1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid
SMILESCCNC(=O)CN1CCC(C(=O)O)CC1
InChIInChI=1S/C10H18N2O3/c1-2-11-9(13)7-12-5-3-8(4-6-12)10(14)15/h8H,2-7H2,1H3,(H,11,13)(H,14,15)
InChIKeyHXHQOLJUTRXZRR-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.08
Rot. Bonds4

About 1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid

1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid (PubChem CID 39243400) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid
PubChem CID39243400
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid
SMILESCCNC(=O)CN1CCC(C(=O)O)CC1
InChIInChI=1S/C10H18N2O3/c1-2-11-9(13)7-12-5-3-8(4-6-12)10(14)15/h8H,2-7H2,1H3,(H,11,13)(H,14,15)
InChIKeyHXHQOLJUTRXZRR-UHFFFAOYSA-N
XLogP-0.08
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(ethylamino)-2-oxoethyl]pyrrolidine-3-carboxylic acid
CID 22322835
ethane;N-ethyl-2-pyrrolidin-1-ylacetamide
CID 144584816
1-[2-(ethylamino)-2-oxoethyl]piperidine-3,4-dicarboxylic acid
CID 112568166
1-[2-oxo-2-(propylamino)ethyl]pyrrolidine-3-carboxylic acid
CID 22322508
1-[2-(cyclohexylmethylamino)-2-oxoethyl]piperidine-4-carboxylic acid
CID 119907812
2-(azetidin-1-yl)-N-ethylacetamide
CID 129266397
1-[2-(cyclopropylamino)-2-oxoethyl]piperidine-4-carboxylic acid
CID 39246836
2-[1-[2-(ethylamino)-2-oxoethyl]piperidin-4-yl]oxyacetic acid
CID 55252054
1-[2-[2-(4-ethoxyphenoxy)ethylamino]-2-oxoethyl]piperidine-4-carboxylic acid
CID 119908123
2-[4-[2-(ethylamino)-2-oxoethyl]-1,4-diazepan-1-yl]acetic acid
CID 55119243
N-ethyl-2-[4-[2-oxo-2-(prop-2-ynylamino)ethyl]piperazin-1-yl]acetamide
CID 36892657
1-[2-(cyclooctylamino)-2-oxoethyl]piperidine-4-carboxylic acid
CID 119908022

Frequently Asked Questions

What is the IUPAC name of 1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid?
The IUPAC name of 1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid (CID 39243400) is 1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid.
What is the SMILES notation for 1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid?
The canonical SMILES for 1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid is CCNC(=O)CN1CCC(C(=O)O)CC1.
What is the InChIKey of 1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid?
The InChIKey is HXHQOLJUTRXZRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-2-11-9(13)7-12-5-3-8(4-6-12)10(14)15/h8H,2-7H2,1H3,(H,11,13)(H,14,15).
What are the key properties of 1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid?
1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid has a molecular weight of 214.26 g/mol, XLogP of -0.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(ethylamino)-2-oxoethyl]piperidine-4-carboxylic acid is sourced from PubChem (CID 39243400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).