2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid

C15H19NO5 — CID 64672584

IUPAC2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid
SMILESCOc1cccc(C(=O)NC2(CC(=O)O)CCCC2)c1O
InChIInChI=1S/C15H19NO5/c1-21-11-6-4-5-10(13(11)19)14(20)16-15(9-12(17)18)7-2-3-8-15/h4-6,19H,2-3,7-9H2,1H3,(H,16,20)(H,17,18)
InChIKeyGTHNQAUSZMRBHA-UHFFFAOYSA-N
MW293.32 g/mol
LogP1.92
Rot. Bonds5

About 2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid

2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid (PubChem CID 64672584) has the molecular formula C15H19NO5 and a molecular weight of 293.32 g/mol. Its IUPAC name is 2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid
PubChem CID64672584
Molecular FormulaC15H19NO5
Molecular Weight293.32 g/mol
Exact Mass293.13
IUPAC Name2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid
SMILESCOc1cccc(C(=O)NC2(CC(=O)O)CCCC2)c1O
InChIInChI=1S/C15H19NO5/c1-21-11-6-4-5-10(13(11)19)14(20)16-15(9-12(17)18)7-2-3-8-15/h4-6,19H,2-3,7-9H2,1H3,(H,16,20)(H,17,18)
InChIKeyGTHNQAUSZMRBHA-UHFFFAOYSA-N
XLogP1.92
TPSA95.86 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 51.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-[(2-methoxybenzoyl)amino]cyclopentyl]acetic acid
CID 64672571
2-[1-[(2-fluoro-6-methoxybenzoyl)amino]cyclopentyl]acetic acid
CID 65433607
2-[1-[(3-hydroxy-2-methylbenzoyl)amino]cyclobutyl]acetic acid
CID 82826485
N-[1-(hydroxymethyl)cyclobutyl]-2-methoxybenzamide
CID 113344829
2-[1-[(2-methoxypyridine-3-carbonyl)amino]cyclobutyl]acetic acid
CID 79848236
2-[1-[(4-methoxybenzoyl)amino]cyclopentyl]acetic acid
CID 64670427
N-[1-(bromomethyl)-4-methylcyclohexyl]-2-hydroxy-3-methoxybenzamide
CID 114314856
2-[1-[(2-fluoro-3-methylbenzoyl)amino]cyclobutyl]acetic acid
CID 81480559
2-[1-[(3-fluoro-4-methoxybenzoyl)amino]cyclopentyl]acetic acid
CID 64672188
2-hydroxy-3-methoxy-N-(4-methylpiperidin-4-yl)benzamide
CID 114696306
2-[1-[(2-bromo-5-methoxybenzoyl)amino]cyclopentyl]acetic acid
CID 64671810
2-[1-[(2-methoxy-5-methylsulfonylbenzoyl)amino]cyclobutyl]acetic acid
CID 120686845

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid (CID 64672584) is 2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid is COc1cccc(C(=O)NC2(CC(=O)O)CCCC2)c1O.
What is the InChIKey of 2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid?
The InChIKey is GTHNQAUSZMRBHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO5/c1-21-11-6-4-5-10(13(11)19)14(20)16-15(9-12(17)18)7-2-3-8-15/h4-6,19H,2-3,7-9H2,1H3,(H,16,20)(H,17,18).
What are the key properties of 2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid?
2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid has a molecular weight of 293.32 g/mol, XLogP of 1.92, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2-hydroxy-3-methoxybenzoyl)amino]cyclopentyl]acetic acid is sourced from PubChem (CID 64672584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).