3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid

C12H20N2O4 — CID 66033013

IUPAC3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid
SMILESO=C(O)C1CCC(NC(=O)N2CCCC(O)C2)C1
InChIInChI=1S/C12H20N2O4/c15-10-2-1-5-14(7-10)12(18)13-9-4-3-8(6-9)11(16)17/h8-10,15H,1-7H2,(H,13,18)(H,16,17)
InChIKeyOLOUKTGHYAERHR-UHFFFAOYSA-N
MW256.30 g/mol
LogP0.41
Rot. Bonds2

About 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid

3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 66033013) has the molecular formula C12H20N2O4 and a molecular weight of 256.30 g/mol. Its IUPAC name is 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid
PubChem CID66033013
Molecular FormulaC12H20N2O4
Molecular Weight256.30 g/mol
Exact Mass256.14
IUPAC Name3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid
SMILESO=C(O)C1CCC(NC(=O)N2CCCC(O)C2)C1
InChIInChI=1S/C12H20N2O4/c15-10-2-1-5-14(7-10)12(18)13-9-4-3-8(6-9)11(16)17/h8-10,15H,1-7H2,(H,13,18)(H,16,17)
InChIKeyOLOUKTGHYAERHR-UHFFFAOYSA-N
XLogP0.41
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 55147885
cis-(1R,3S)-3-(azocane-1-carbonylamino)cyclopentane-1-carboxylic acid
CID 106324241
1-[[(1S,3R)-3-(piperidine-1-carbonyl)cyclopentyl]carbamoyl]piperidine-3-carboxylic acid
CID 122013071
3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide
CID 110896538
3-[[3-(methylcarbamoyl)piperidine-1-carbonyl]amino]cyclopentane-1-carboxylic acid
CID 103197211
3-[(3-methoxycarbonylpiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 115535206
cis-(1R,3S)-3-[(4-hydroxy-3-methylpiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 106320203
cis-(1R,3S)-3-[(2-methyl-1,4-oxazepane-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 114172994
cis-(1R,3S)-3-[(3-propoxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 106319520
N-cyclopropyl-3-hydroxypyrrolidine-1-carboxamide
CID 62916085
(3S)-1-[(3,5-dimethylcyclohexyl)carbamoyl]piperidine-3-carboxylic acid
CID 81126261
3-[(2-methylmorpholine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 66030812

Frequently Asked Questions

What is the IUPAC name of 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid (CID 66033013) is 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid is O=C(O)C1CCC(NC(=O)N2CCCC(O)C2)C1.
What is the InChIKey of 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is OLOUKTGHYAERHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O4/c15-10-2-1-5-14(7-10)12(18)13-9-4-3-8(6-9)11(16)17/h8-10,15H,1-7H2,(H,13,18)(H,16,17).
What are the key properties of 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid?
3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 256.30 g/mol, XLogP of 0.41, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-hydroxypiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 66033013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).