2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide

C13H16INO2 — CID 110013609

IUPAC2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide
SMILESCc1cc(I)ccc1NC(=O)C1CCCC1O
InChIInChI=1S/C13H16INO2/c1-8-7-9(14)5-6-11(8)15-13(17)10-3-2-4-12(10)16/h5-7,10,12,16H,2-4H2,1H3,(H,15,17)
InChIKeyHGAZIIRCOILLJZ-UHFFFAOYSA-N
MW345.18 g/mol
LogP2.70
Rot. Bonds2

About 2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide

2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide (PubChem CID 110013609) has the molecular formula C13H16INO2 and a molecular weight of 345.18 g/mol. Its IUPAC name is 2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide
PubChem CID110013609
Molecular FormulaC13H16INO2
Molecular Weight345.18 g/mol
Exact Mass345.02
IUPAC Name2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide
SMILESCc1cc(I)ccc1NC(=O)C1CCCC1O
InChIInChI=1S/C13H16INO2/c1-8-7-9(14)5-6-11(8)15-13(17)10-3-2-4-12(10)16/h5-7,10,12,16H,2-4H2,1H3,(H,15,17)
InChIKeyHGAZIIRCOILLJZ-UHFFFAOYSA-N
XLogP2.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.18
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide 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

N-(4-iodo-2-methylphenyl)-1,3,5-trithiane-2-carboxamide
CID 1181694
N-(5-fluoro-2-methylphenyl)-2-hydroxycyclopentane-1-carboxamide
CID 110013638
2-hydroxy-N-(2-methoxy-4-methylphenyl)cyclopentane-1-carboxamide
CID 110015372
2-amino-N-(2,4-dimethylphenyl)cyclopentane-1-carboxamide
CID 64816599
N-cyclohexyl-N'-(4-iodo-2-methylphenyl)oxamide
CID 47224422
N-(4-iodo-2-methylphenyl)-2-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 84569194
trans-(1S,2S)-2-[[4-[4-[[(1R,2S)-2-carboxycyclohexanecarbonyl]amino]-3-methylphenyl]-2-methylphenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 51622080
N-(2-fluoro-5-methylphenyl)-2-hydroxycyclopentane-1-carboxamide
CID 110013794
N-(4-iodo-2-methylphenyl)-4-methylpiperidine-2-carboxamide
CID 114423070
2-(cyclopropylmethylamino)-N-(4-iodo-2-methylphenyl)acetamide
CID 54924927
2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119679603
N'-(4-iodo-2-methylphenyl)-N-methyloxamide
CID 47224837

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide?
The IUPAC name of 2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide (CID 110013609) is 2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide is Cc1cc(I)ccc1NC(=O)C1CCCC1O.
What is the InChIKey of 2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide?
The InChIKey is HGAZIIRCOILLJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16INO2/c1-8-7-9(14)5-6-11(8)15-13(17)10-3-2-4-12(10)16/h5-7,10,12,16H,2-4H2,1H3,(H,15,17).
What are the key properties of 2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide?
2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide has a molecular weight of 345.18 g/mol, XLogP of 2.70, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(4-iodo-2-methylphenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 110013609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).