2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide

C13H17NO4 — CID 107722870

IUPAC2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide
SMILESCOC1CCCC1NC(=O)c1cc(O)ccc1O
InChIInChI=1S/C13H17NO4/c1-18-12-4-2-3-10(12)14-13(17)9-7-8(15)5-6-11(9)16/h5-7,10,12,15-16H,2-4H2,1H3,(H,14,17)
InChIKeyLEAMZHKDLLVVMW-UHFFFAOYSA-N
MW251.28 g/mol
LogP1.40
Rot. Bonds3

About 2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide

2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide (PubChem CID 107722870) has the molecular formula C13H17NO4 and a molecular weight of 251.28 g/mol. Its IUPAC name is 2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide.

Molecular Properties

Compound Name2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide
PubChem CID107722870
Molecular FormulaC13H17NO4
Molecular Weight251.28 g/mol
Exact Mass251.12
IUPAC Name2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide
SMILESCOC1CCCC1NC(=O)c1cc(O)ccc1O
InChIInChI=1S/C13H17NO4/c1-18-12-4-2-3-10(12)14-13(17)9-7-8(15)5-6-11(9)16/h5-7,10,12,15-16H,2-4H2,1H3,(H,14,17)
InChIKeyLEAMZHKDLLVVMW-UHFFFAOYSA-N
XLogP1.40
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.28
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze 2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-2-hydroxy-N-(2-methoxycyclopentyl)benzamide
CID 62087187
4-hydroxy-N-(2-methoxycyclopentyl)benzamide
CID 62087188
2,3-dihydroxy-N-(2-methoxycyclopentyl)benzamide
CID 114344265
2-amino-N-(2-methoxycyclopentyl)benzamide
CID 62086922
N-[2-(aminomethyl)cyclohexyl]-2,5-dihydroxybenzamide
CID 107725193
N-[2-(chloromethyl)cyclohexyl]-2,5-dihydroxybenzamide
CID 114179613
2-amino-5-fluoro-N-(2-methoxycyclopentyl)benzamide
CID 62086919
1-hydroxy-N-(2-methoxycyclopentyl)naphthalene-2-carboxamide
CID 62086836
2-hydroxy-5-methoxy-N-(2-methylcyclohexyl)benzamide
CID 54943452
2-fluoro-N-(2-methoxycyclopentyl)-4-sulfamoylbenzamide
CID 62088634
N-(2-bromocyclohexyl)-2-hydroxy-5-methoxybenzamide
CID 114312002
2,5-dihydroxy-N-(3-methylcyclopentyl)benzamide
CID 107723891

Frequently Asked Questions

What is the IUPAC name of 2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide?
The IUPAC name of 2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide (CID 107722870) is 2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide.
What is the SMILES notation for 2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide?
The canonical SMILES for 2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide is COC1CCCC1NC(=O)c1cc(O)ccc1O.
What is the InChIKey of 2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide?
The InChIKey is LEAMZHKDLLVVMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO4/c1-18-12-4-2-3-10(12)14-13(17)9-7-8(15)5-6-11(9)16/h5-7,10,12,15-16H,2-4H2,1H3,(H,14,17).
What are the key properties of 2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide?
2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide has a molecular weight of 251.28 g/mol, XLogP of 1.40, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide is sourced from PubChem (CID 107722870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).