1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid

C11H19N3O3 — CID 61405040

IUPAC1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CCCC1)N1CCNCC1
InChIInChI=1S/C11H19N3O3/c15-9(16)11(3-1-2-4-11)13-10(17)14-7-5-12-6-8-14/h12H,1-8H2,(H,13,17)(H,15,16)
InChIKeyQNHJABLKLVEYRH-UHFFFAOYSA-N
MW241.29 g/mol
LogP-0.00
Rot. Bonds2

About 1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid

1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid (PubChem CID 61405040) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is 1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid
PubChem CID61405040
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid
SMILESO=C(NC1(C(=O)O)CCCC1)N1CCNCC1
InChIInChI=1S/C11H19N3O3/c15-9(16)11(3-1-2-4-11)13-10(17)14-7-5-12-6-8-14/h12H,1-8H2,(H,13,17)(H,15,16)
InChIKeyQNHJABLKLVEYRH-UHFFFAOYSA-N
XLogP-0.00
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-0.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(4-aminopiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 61403018
1-[(4-hydroxy-4-methylazepane-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 107405645
1-[(2-methyl-2-piperazin-1-ylpropanoyl)amino]cyclohexane-1-carboxylic acid
CID 80547816
1-[(3,5-dimethylpiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 61190558
1-[(4-methoxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 11608918
1-[[2-(1,4-diazepan-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 55121397
1-(morpholine-4-carbonylamino)cyclopropane-1-carboxylic acid
CID 65451097
1-[(4-butan-2-ylpiperazine-1-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 62777140
1-[(4-cyclopentylpiperazine-1-carbonyl)amino]cyclobutane-1-carboxylic acid
CID 81155811
1-[(3-methylpyrrolidine-1-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 61225245
1-(1,2,4,5-tetrahydro-3-benzazepine-3-carbonylamino)cyclobutane-1-carboxylic acid
CID 81156480
1-[(3,3,4-trimethylpiperazine-1-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 63615862

Frequently Asked Questions

What is the IUPAC name of 1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid?
The IUPAC name of 1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid (CID 61405040) is 1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid is O=C(NC1(C(=O)O)CCCC1)N1CCNCC1.
What is the InChIKey of 1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid?
The InChIKey is QNHJABLKLVEYRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c15-9(16)11(3-1-2-4-11)13-10(17)14-7-5-12-6-8-14/h12H,1-8H2,(H,13,17)(H,15,16).
What are the key properties of 1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid?
1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid has a molecular weight of 241.29 g/mol, XLogP of -0.00, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(piperazine-1-carbonylamino)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 61405040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).