1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid

C8H14N2O3 — CID 82238244

IUPAC1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid
SMILESNC(=O)CNC1(C(=O)O)CCCC1
InChIInChI=1S/C8H14N2O3/c9-6(11)5-10-8(7(12)13)3-1-2-4-8/h10H,1-5H2,(H2,9,11)(H,12,13)
InChIKeyZVYDOPSJFKEXIS-UHFFFAOYSA-N
MW186.21 g/mol
LogP-0.54
Rot. Bonds4

About 1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid

1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 82238244) has the molecular formula C8H14N2O3 and a molecular weight of 186.21 g/mol. Its IUPAC name is 1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid
PubChem CID82238244
Molecular FormulaC8H14N2O3
Molecular Weight186.21 g/mol
Exact Mass186.10
IUPAC Name1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid
SMILESNC(=O)CNC1(C(=O)O)CCCC1
InChIInChI=1S/C8H14N2O3/c9-6(11)5-10-8(7(12)13)3-1-2-4-8/h10H,1-5H2,(H2,9,11)(H,12,13)
InChIKeyZVYDOPSJFKEXIS-UHFFFAOYSA-N
XLogP-0.54
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-0.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2-amino-2-oxoethyl)amino]cyclobutane-1-carboxylic acid
CID 81167542
4-[(2-amino-2-oxoethyl)amino]oxane-4-carboxylic acid
CID 82238247
1-[(2-methoxy-2-oxoethyl)amino]cyclopentane-1-carboxylic acid
CID 114987731
1-[[2-(methylamino)-2-oxoethyl]amino]cyclohexane-1-carboxylic acid
CID 82238273
1-(3-aminopropylamino)cyclooctane-1-carboxylic acid
CID 115000755
1-(2-hydroxypropylamino)cyclooctane-1-carboxylic acid
CID 82238303
1-(propylamino)cycloheptane-1-carboxylic acid
CID 43754029
1-(2,2-difluoroethylamino)cyclobutane-1-carboxylic acid
CID 81166849
1-[[2-oxo-2-(prop-2-ynylamino)ethyl]amino]cyclobutane-1-carboxylic acid
CID 81167570
1-[[2-[methyl(propan-2-yl)amino]-2-oxoethyl]amino]cyclobutane-1-carboxylic acid
CID 81168087
1-(2-acetamidoethylamino)cyclohexane-1-carboxylic acid
CID 114988533
1-(2-methylsulfonylethylamino)cyclopentane-1-carboxylic acid
CID 114992122

Frequently Asked Questions

What is the IUPAC name of 1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid (CID 82238244) is 1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid is NC(=O)CNC1(C(=O)O)CCCC1.
What is the InChIKey of 1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is ZVYDOPSJFKEXIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3/c9-6(11)5-10-8(7(12)13)3-1-2-4-8/h10H,1-5H2,(H2,9,11)(H,12,13).
What are the key properties of 1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid?
1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 186.21 g/mol, XLogP of -0.54, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-amino-2-oxoethyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 82238244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).