2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid

C10H19NO3 — CID 106940301

IUPAC2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid
SMILESCC(OCC1CCCC1CN)C(=O)O
InChIInChI=1S/C10H19NO3/c1-7(10(12)13)14-6-9-4-2-3-8(9)5-11/h7-9H,2-6,11H2,1H3,(H,12,13)
InChIKeyNEMYZIOYMNIOQX-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.85
Rot. Bonds5

About 2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid

2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid (PubChem CID 106940301) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid.

Molecular Properties

Compound Name2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid
PubChem CID106940301
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid
SMILESCC(OCC1CCCC1CN)C(=O)O
InChIInChI=1S/C10H19NO3/c1-7(10(12)13)14-6-9-4-2-3-8(9)5-11/h7-9H,2-6,11H2,1H3,(H,12,13)
InChIKeyNEMYZIOYMNIOQX-UHFFFAOYSA-N
XLogP0.85
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-Amino-2-(2-ethylhexoxy)butanoic acid
CID 64695034
4-Amino-2-(cyclopentylmethoxy)butanoic acid
CID 66322941
2-[2-(Aminomethyl)cyclopentyl]oxypropanoic acid
CID 106940178
2-[2-(Aminomethyl)cyclopentyl]oxypentanoic acid
CID 106940188
2-[2-(Aminomethyl)cyclopentyl]oxybutanoic acid
CID 106940205
2-[2-(Aminomethyl)cyclohexyl]oxypropanoic acid
CID 106940224
2-[2-(Aminomethyl)cyclohexyl]oxybutanoic acid
CID 106940249
2-[[2-(Aminomethyl)cyclohexyl]methoxy]propanoic acid
CID 106940265
2-[[2-(Aminomethyl)cyclohexyl]methoxy]pentanoic acid
CID 106940273
2-[[2-(Aminomethyl)cyclohexyl]methoxy]butanoic acid
CID 106940287
Propan-2-yl 2-[[2-(aminomethyl)cyclopentyl]methoxy]acetate
CID 106940308
2-[[2-(Aminomethyl)cyclopentyl]methoxy]pentanoic acid
CID 106940310

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid?
The IUPAC name of 2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid (CID 106940301) is 2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid.
What is the SMILES notation for 2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid?
The canonical SMILES for 2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid is CC(OCC1CCCC1CN)C(=O)O.
What is the InChIKey of 2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid?
The InChIKey is NEMYZIOYMNIOQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-7(10(12)13)14-6-9-4-2-3-8(9)5-11/h7-9H,2-6,11H2,1H3,(H,12,13).
What are the key properties of 2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid?
2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid has a molecular weight of 201.27 g/mol, XLogP of 0.85, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(aminomethyl)cyclopentyl]methoxy]propanoic acid is sourced from PubChem (CID 106940301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).