2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid

C16H28N2O3 — CID 103978117

IUPAC2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid
SMILESCC1(C)CC(NC(=O)C2CCCC2C(=O)O)CC(C)(C)N1
InChIInChI=1S/C16H28N2O3/c1-15(2)8-10(9-16(3,4)18-15)17-13(19)11-6-5-7-12(11)14(20)21/h10-12,18H,5-9H2,1-4H3,(H,17,19)(H,20,21)
InChIKeyFOXSGXOVQVYOSN-UHFFFAOYSA-N
MW296.41 g/mol
LogP1.91
Rot. Bonds3

About 2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid

2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid (PubChem CID 103978117) has the molecular formula C16H28N2O3 and a molecular weight of 296.41 g/mol. Its IUPAC name is 2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid
PubChem CID103978117
Molecular FormulaC16H28N2O3
Molecular Weight296.41 g/mol
Exact Mass296.21
IUPAC Name2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid
SMILESCC1(C)CC(NC(=O)C2CCCC2C(=O)O)CC(C)(C)N1
InChIInChI=1S/C16H28N2O3/c1-15(2)8-10(9-16(3,4)18-15)17-13(19)11-6-5-7-12(11)14(20)21/h10-12,18H,5-9H2,1-4H3,(H,17,19)(H,20,21)
InChIKeyFOXSGXOVQVYOSN-UHFFFAOYSA-N
XLogP1.91
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid?
The IUPAC name of 2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid (CID 103978117) is 2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid is CC1(C)CC(NC(=O)C2CCCC2C(=O)O)CC(C)(C)N1.
What is the InChIKey of 2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid?
The InChIKey is FOXSGXOVQVYOSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O3/c1-15(2)8-10(9-16(3,4)18-15)17-13(19)11-6-5-7-12(11)14(20)21/h10-12,18H,5-9H2,1-4H3,(H,17,19)(H,20,21).
What are the key properties of 2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid?
2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid has a molecular weight of 296.41 g/mol, XLogP of 1.91, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 103978117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).