5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid

C14H24N2O4 — CID 102688874

IUPAC5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid
SMILESCN(C)C1(CNC(=O)C2CCC(C(=O)O)O2)CCCC1
InChIInChI=1S/C14H24N2O4/c1-16(2)14(7-3-4-8-14)9-15-12(17)10-5-6-11(20-10)13(18)19/h10-11H,3-9H2,1-2H3,(H,15,17)(H,18,19)
InChIKeyZXEDHGFECKSOKV-UHFFFAOYSA-N
MW284.36 g/mol
LogP0.61
Rot. Bonds5

About 5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid

5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid (PubChem CID 102688874) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is 5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid.

Molecular Properties

Compound Name5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid
PubChem CID102688874
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid
SMILESCN(C)C1(CNC(=O)C2CCC(C(=O)O)O2)CCCC1
InChIInChI=1S/C14H24N2O4/c1-16(2)14(7-3-4-8-14)9-15-12(17)10-5-6-11(20-10)13(18)19/h10-11H,3-9H2,1-2H3,(H,15,17)(H,18,19)
InChIKeyZXEDHGFECKSOKV-UHFFFAOYSA-N
XLogP0.61
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid?
The IUPAC name of 5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid (CID 102688874) is 5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid.
What is the SMILES notation for 5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid?
The canonical SMILES for 5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid is CN(C)C1(CNC(=O)C2CCC(C(=O)O)O2)CCCC1.
What is the InChIKey of 5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid?
The InChIKey is ZXEDHGFECKSOKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O4/c1-16(2)14(7-3-4-8-14)9-15-12(17)10-5-6-11(20-10)13(18)19/h10-11H,3-9H2,1-2H3,(H,15,17)(H,18,19).
What are the key properties of 5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid?
5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid has a molecular weight of 284.36 g/mol, XLogP of 0.61, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[1-(dimethylamino)cyclopentyl]methylcarbamoyl]oxolane-2-carboxylic acid is sourced from PubChem (CID 102688874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).