2-(2-aminocyclopentyl)oxybenzoic acid

C12H15NO3 — CID 117053950

IUPAC2-(2-aminocyclopentyl)oxybenzoic acid
SMILESNC1CCCC1Oc1ccccc1C(=O)O
InChIInChI=1S/C12H15NO3/c13-9-5-3-7-11(9)16-10-6-2-1-4-8(10)12(14)15/h1-2,4,6,9,11H,3,5,7,13H2,(H,14,15)
InChIKeyXAPHSEPQQZMNRT-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.64
Rot. Bonds3

About 2-(2-aminocyclopentyl)oxybenzoic acid

2-(2-aminocyclopentyl)oxybenzoic acid (PubChem CID 117053950) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-(2-aminocyclopentyl)oxybenzoic acid.

Molecular Properties

Compound Name2-(2-aminocyclopentyl)oxybenzoic acid
PubChem CID117053950
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC Name2-(2-aminocyclopentyl)oxybenzoic acid
SMILESNC1CCCC1Oc1ccccc1C(=O)O
InChIInChI=1S/C12H15NO3/c13-9-5-3-7-11(9)16-10-6-2-1-4-8(10)12(14)15/h1-2,4,6,9,11H,3,5,7,13H2,(H,14,15)
InChIKeyXAPHSEPQQZMNRT-UHFFFAOYSA-N
XLogP1.64
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-aminocyclohexyl)oxyphenyl]acetic acid
CID 117054327
2-[2-(dimethylamino)cyclohexyl]oxybenzoic acid
CID 82037587
2-(2-aminocyclopentyl)oxy-5-fluorobenzamide
CID 113395445
2-(1-methylpiperidin-4-yl)oxybenzoic acid
CID 39203185
2-(2-ethoxyphenoxy)cyclopentan-1-amine
CID 16781253
2-(4-propan-2-ylcyclohexyl)oxybenzoic acid
CID 70444480
2-(1-methylazepan-4-yl)oxybenzoic acid
CID 117053972
2-(2-aminocyclohexyl)oxy-6-bromobenzamide
CID 114887759
2-[2-(trifluoromethyl)phenoxy]cyclohexan-1-amine
CID 45283482
2-(2-aminocyclohexyl)oxy-4-bromobenzamide
CID 114907115
2-(3,4-dimethylcyclohexyl)oxybenzoic acid
CID 64745909
2-(2-cyanocycloheptyl)oxybenzamide
CID 43292463

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminocyclopentyl)oxybenzoic acid?
The IUPAC name of 2-(2-aminocyclopentyl)oxybenzoic acid (CID 117053950) is 2-(2-aminocyclopentyl)oxybenzoic acid.
What is the SMILES notation for 2-(2-aminocyclopentyl)oxybenzoic acid?
The canonical SMILES for 2-(2-aminocyclopentyl)oxybenzoic acid is NC1CCCC1Oc1ccccc1C(=O)O.
What is the InChIKey of 2-(2-aminocyclopentyl)oxybenzoic acid?
The InChIKey is XAPHSEPQQZMNRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c13-9-5-3-7-11(9)16-10-6-2-1-4-8(10)12(14)15/h1-2,4,6,9,11H,3,5,7,13H2,(H,14,15).
What are the key properties of 2-(2-aminocyclopentyl)oxybenzoic acid?
2-(2-aminocyclopentyl)oxybenzoic acid has a molecular weight of 221.26 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminocyclopentyl)oxybenzoic acid is sourced from PubChem (CID 117053950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).