2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid

C10H17NO4 — CID 103978359

IUPAC2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid
SMILESCN(CCO)C(=O)C1CCCC1C(=O)O
InChIInChI=1S/C10H17NO4/c1-11(5-6-12)9(13)7-3-2-4-8(7)10(14)15/h7-8,12H,2-6H2,1H3,(H,14,15)
InChIKeyXXIQLVZSLMFUBS-UHFFFAOYSA-N
MW215.25 g/mol
LogP-0.06
Rot. Bonds4

About 2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid

2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid (PubChem CID 103978359) has the molecular formula C10H17NO4 and a molecular weight of 215.25 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid
PubChem CID103978359
Molecular FormulaC10H17NO4
Molecular Weight215.25 g/mol
Exact Mass215.12
IUPAC Name2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid
SMILESCN(CCO)C(=O)C1CCCC1C(=O)O
InChIInChI=1S/C10H17NO4/c1-11(5-6-12)9(13)7-3-2-4-8(7)10(14)15/h7-8,12H,2-6H2,1H3,(H,14,15)
InChIKeyXXIQLVZSLMFUBS-UHFFFAOYSA-N
XLogP-0.06
TPSA77.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclobutyl(2-hydroxyethyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 102860862
2-[methyl-[2-(methylamino)ethyl]carbamoyl]cyclopentane-1-carboxylic acid
CID 103978815
2-[methyl(3,3,3-trifluoropropyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978888
2-[cyclohexyl(2-hydroxyethyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978364
2-[(2-amino-2-oxoethyl)-methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 103977737
cis-(1S,2R)-2-[(3-ethoxy-3-oxopropyl)-methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 114092193
2-[(2-methoxy-2-oxoethyl)-methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 103978420
2-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]cyclopentane-1-carboxylic acid
CID 103978797
cis-(1S,2R)-2-[3-methoxypropyl(methyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 94912240
2-[2-ethoxyethyl(methyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 81059586
2-[2-hydroxyethyl(methyl)amino]cyclopentane-1-carboxylic acid
CID 83817695
trans-(1R,2R)-2-[[2-(hydroxyamino)-2-oxoethyl]-methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 10037452

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid?
The IUPAC name of 2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid (CID 103978359) is 2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid is CN(CCO)C(=O)C1CCCC1C(=O)O.
What is the InChIKey of 2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid?
The InChIKey is XXIQLVZSLMFUBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO4/c1-11(5-6-12)9(13)7-3-2-4-8(7)10(14)15/h7-8,12H,2-6H2,1H3,(H,14,15).
What are the key properties of 2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid?
2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid has a molecular weight of 215.25 g/mol, XLogP of -0.06, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 103978359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).