N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide

C12H15IN2O2 — CID 107732083

IUPACN-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide
SMILESNC1CCCC1NC(=O)c1cc(I)ccc1O
InChIInChI=1S/C12H15IN2O2/c13-7-4-5-11(16)8(6-7)12(17)15-10-3-1-2-9(10)14/h4-6,9-10,16H,1-3,14H2,(H,15,17)
InChIKeyMFQBERPCLANIGJ-UHFFFAOYSA-N
MW346.17 g/mol
LogP1.61
Rot. Bonds2

About N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide

N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide (PubChem CID 107732083) has the molecular formula C12H15IN2O2 and a molecular weight of 346.17 g/mol. Its IUPAC name is N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide.

Molecular Properties

Compound NameN-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide
PubChem CID107732083
Molecular FormulaC12H15IN2O2
Molecular Weight346.17 g/mol
Exact Mass346.02
IUPAC NameN-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide
SMILESNC1CCCC1NC(=O)c1cc(I)ccc1O
InChIInChI=1S/C12H15IN2O2/c13-7-4-5-11(16)8(6-7)12(17)15-10-3-1-2-9(10)14/h4-6,9-10,16H,1-3,14H2,(H,15,17)
InChIKeyMFQBERPCLANIGJ-UHFFFAOYSA-N
XLogP1.61
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.17
LogP ≤ 51.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(2-hydroxy-5-iodobenzoyl)amino]cyclohexane-1-carboxylic acid
CID 107731367
N-(2-aminocyclopentyl)-2,4-dihydroxybenzamide
CID 63251225
N-(2-aminocyclopentyl)-3-chloro-4-hydroxybenzamide
CID 63251551
2-hydroxy-5-iodo-N-[(3S)-pyrrolidin-3-yl]benzamide
CID 107732166
N-(2-aminocyclopentyl)-2-chlorobenzamide
CID 63251263
N-(2-aminocyclopentyl)-2,4-difluorobenzamide
CID 55169899
2-hydroxy-5-iodo-N-(thiolan-3-yl)benzamide
CID 103711939
N-(1,1-dioxothian-3-yl)-2-hydroxy-5-iodobenzamide
CID 103710763
N-(2-aminocycloheptyl)-4-hydroxy-3-methylbenzamide
CID 107672030
N-[2-(aminomethyl)cyclohexyl]-2,5-dihydroxybenzamide
CID 107725193
N-(2-aminocyclopentyl)-2-chloro-4-fluorobenzamide
CID 63251463
2-bromo-N-[2-(chloromethyl)cyclopentyl]-5-iodobenzamide
CID 106366054

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide?
The IUPAC name of N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide (CID 107732083) is N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide.
What is the SMILES notation for N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide?
The canonical SMILES for N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide is NC1CCCC1NC(=O)c1cc(I)ccc1O.
What is the InChIKey of N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide?
The InChIKey is MFQBERPCLANIGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15IN2O2/c13-7-4-5-11(16)8(6-7)12(17)15-10-3-1-2-9(10)14/h4-6,9-10,16H,1-3,14H2,(H,15,17).
What are the key properties of N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide?
N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide has a molecular weight of 346.17 g/mol, XLogP of 1.61, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclopentyl)-2-hydroxy-5-iodobenzamide is sourced from PubChem (CID 107732083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).