1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid

C14H23NO4 — CID 114095382

IUPAC1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid
SMILESCC1OCCC1(C)NC(=O)CC1(C(=O)O)CCCC1
InChIInChI=1S/C14H23NO4/c1-10-13(2,7-8-19-10)15-11(16)9-14(12(17)18)5-3-4-6-14/h10H,3-9H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyRDOAGOUMYADHMP-UHFFFAOYSA-N
MW269.34 g/mol
LogP1.71
Rot. Bonds4

About 1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid

1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid (PubChem CID 114095382) has the molecular formula C14H23NO4 and a molecular weight of 269.34 g/mol. Its IUPAC name is 1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid
PubChem CID114095382
Molecular FormulaC14H23NO4
Molecular Weight269.34 g/mol
Exact Mass269.16
IUPAC Name1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid
SMILESCC1OCCC1(C)NC(=O)CC1(C(=O)O)CCCC1
InChIInChI=1S/C14H23NO4/c1-10-13(2,7-8-19-10)15-11(16)9-14(12(17)18)5-3-4-6-14/h10H,3-9H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyRDOAGOUMYADHMP-UHFFFAOYSA-N
XLogP1.71
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[[1-(hydroxymethyl)-4-methylcyclohexyl]amino]-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 62552996
1-[2-oxo-2-(propan-2-ylamino)ethyl]cycloheptane-1-carboxylic acid
CID 43529300
1-[2-oxo-2-[(2,2,3,3-tetramethylcyclopropyl)amino]ethyl]cyclohexane-1-carboxylic acid
CID 79358096
1-[2-(dicyclopropylmethylamino)-2-oxoethyl]cyclohexane-1-carboxylic acid
CID 60941202
1-[2-oxo-2-(pentan-3-ylamino)ethyl]cyclopentane-1-carboxylic acid
CID 43396421
N-(2,3-dimethyloxolan-3-yl)-2-morpholin-2-ylacetamide
CID 114096023
N-(2,3-dimethyloxolan-3-yl)-3-piperidin-4-ylpropanamide
CID 114096015
N-cyclopentyl-2-[(2,3-dimethyloxolan-3-yl)amino]acetamide
CID 103581151
CID 89009885
CID 89009885
1-[2-[(2-methylcyclohexyl)amino]-2-oxoethyl]cycloheptane-1-carboxylic acid
CID 43529605
1-[2-[(2,2-dimethylcyclohexyl)amino]-2-oxoethyl]cyclohexane-1-carboxylic acid
CID 79856385
1-[2-[(4-ethylcyclohexyl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 61467269

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid (CID 114095382) is 1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid is CC1OCCC1(C)NC(=O)CC1(C(=O)O)CCCC1.
What is the InChIKey of 1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid?
The InChIKey is RDOAGOUMYADHMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO4/c1-10-13(2,7-8-19-10)15-11(16)9-14(12(17)18)5-3-4-6-14/h10H,3-9H2,1-2H3,(H,15,16)(H,17,18).
What are the key properties of 1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid?
1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid has a molecular weight of 269.34 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2,3-dimethyloxolan-3-yl)amino]-2-oxoethyl]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 114095382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).