1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid

C8H15NO3 — CID 23530558

IUPAC1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid
SMILESCONCC1(C(=O)O)CCCC1
InChIInChI=1S/C8H15NO3/c1-12-9-6-8(7(10)11)4-2-3-5-8/h9H,2-6H2,1H3,(H,10,11)
InChIKeyZTBQURKJECCUHT-UHFFFAOYSA-N
MW173.21 g/mol
LogP0.78
Rot. Bonds4

About 1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid

1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid (PubChem CID 23530558) has the molecular formula C8H15NO3 and a molecular weight of 173.21 g/mol. Its IUPAC name is 1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid
PubChem CID23530558
Molecular FormulaC8H15NO3
Molecular Weight173.21 g/mol
Exact Mass173.11
IUPAC Name1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid
SMILESCONCC1(C(=O)O)CCCC1
InChIInChI=1S/C8H15NO3/c1-12-9-6-8(7(10)11)4-2-3-5-8/h9H,2-6H2,1H3,(H,10,11)
InChIKeyZTBQURKJECCUHT-UHFFFAOYSA-N
XLogP0.78
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-[[[2-(2-methoxyethoxy)acetyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 81361985
1-[[(2-methoxyacetyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 115435584
1-[(3-methoxypropanoylamino)methyl]cyclopentane-1-carboxylic acid
CID 81362446
1-[[(4-methoxy-3-methylbutanoyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 115432964
1-[[(2-methoxy-2-oxoethyl)sulfonylamino]methyl]cyclopentane-1-carboxylic acid
CID 113309110
1-[[(2-methoxy-2-oxoethyl)carbamoylamino]methyl]cycloheptane-1-carboxylic acid
CID 115444671
1-[(3-methylbutanoylamino)methyl]cyclopentane-1-carboxylic acid
CID 81367949
1-[(ethoxycarbonylamino)methyl]cyclohexane-1-carboxylic acid
CID 115435935
1-[[[2-methoxyethyl(methyl)carbamoyl]amino]methyl]cycloheptane-1-carboxylic acid
CID 115444756
1-[(phenylmethoxyamino)methyl]cyclopentane-1-carboxylic acid
CID 71416986
1-[(carbamoylamino)methyl]cyclopentane-1-carboxylic acid
CID 115433058
1-[[[2-ethoxyethyl(methyl)carbamoyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 115437002

Frequently Asked Questions

What is the IUPAC name of 1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid (CID 23530558) is 1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid is CONCC1(C(=O)O)CCCC1.
What is the InChIKey of 1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid?
The InChIKey is ZTBQURKJECCUHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3/c1-12-9-6-8(7(10)11)4-2-3-5-8/h9H,2-6H2,1H3,(H,10,11).
What are the key properties of 1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid?
1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid has a molecular weight of 173.21 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(methoxyamino)methyl]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 23530558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).