1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide

C7H14BrNO2 — CID 167733318

IUPAC1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide
SMILESBr.CNC1(C(=O)O)CCCC1
InChIInChI=1S/C7H13NO2.BrH/c1-8-7(6(9)10)4-2-3-5-7;/h8H,2-5H2,1H3,(H,9,10);1H
InChIKeyOJGWINLWLKMHKK-UHFFFAOYSA-N
MW224.10 g/mol
LogP1.18
Rot. Bonds2

About 1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide

1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide (PubChem CID 167733318) has the molecular formula C7H14BrNO2 and a molecular weight of 224.10 g/mol. Its IUPAC name is 1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide.

Molecular Properties

Compound Name1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide
PubChem CID167733318
Molecular FormulaC7H14BrNO2
Molecular Weight224.10 g/mol
Exact Mass223.02
IUPAC Name1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide
SMILESBr.CNC1(C(=O)O)CCCC1
InChIInChI=1S/C7H13NO2.BrH/c1-8-7(6(9)10)4-2-3-5-7;/h8H,2-5H2,1H3,(H,9,10);1H
InChIKeyOJGWINLWLKMHKK-UHFFFAOYSA-N
XLogP1.18
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.10
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide?
The IUPAC name of 1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide (CID 167733318) is 1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide.
What is the SMILES notation for 1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide?
The canonical SMILES for 1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide is Br.CNC1(C(=O)O)CCCC1.
What is the InChIKey of 1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide?
The InChIKey is OJGWINLWLKMHKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2.BrH/c1-8-7(6(9)10)4-2-3-5-7;/h8H,2-5H2,1H3,(H,9,10);1H.
What are the key properties of 1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide?
1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide has a molecular weight of 224.10 g/mol, XLogP of 1.18, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylamino)cyclopentane-1-carboxylic acid;hydrobromide is sourced from PubChem (CID 167733318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).