3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide

C12H15IN2O — CID 66030489

IUPAC3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)Nc2ccccc2I)C1
InChIInChI=1S/C12H15IN2O/c13-10-3-1-2-4-11(10)15-12(16)8-5-6-9(14)7-8/h1-4,8-9H,5-7,14H2,(H,15,16)
InChIKeyDXUXRBHABOIBIE-UHFFFAOYSA-N
MW330.17 g/mol
LogP2.36
Rot. Bonds2

About 3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide

3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide (PubChem CID 66030489) has the molecular formula C12H15IN2O and a molecular weight of 330.17 g/mol. Its IUPAC name is 3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide
PubChem CID66030489
Molecular FormulaC12H15IN2O
Molecular Weight330.17 g/mol
Exact Mass330.02
IUPAC Name3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)Nc2ccccc2I)C1
InChIInChI=1S/C12H15IN2O/c13-10-3-1-2-4-11(10)15-12(16)8-5-6-9(14)7-8/h1-4,8-9H,5-7,14H2,(H,15,16)
InChIKeyDXUXRBHABOIBIE-UHFFFAOYSA-N
XLogP2.36
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.17
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-amino-N-(2-iodophenyl)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

3-amino-N-(2-phenylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119675324
3-amino-N-[2-(dimethylamino)phenyl]cyclopentane-1-carboxamide
CID 66010603
3-amino-N-(2,3-difluorophenyl)cyclopentane-1-carboxamide
CID 66009400
3-amino-N-(2-pyrazol-1-ylphenyl)cyclopentane-1-carboxamide
CID 66010182
N-(2-iodophenyl)cyclopent-3-ene-1-carboxamide
CID 64767364
3-amino-N-(2-phenylsulfanylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119674872
3-amino-N-(2-propan-2-ylsulfanylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119797989
2-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide
CID 64824088
N-[2-[[acetyl(methyl)amino]methyl]phenyl]-3-aminocyclopentane-1-carboxamide
CID 66007479
3-amino-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]cyclopentane-1-carboxamide
CID 119676621
N-[4-[(3-aminocyclopentanecarbonyl)amino]-2,5-dimethoxyphenyl]benzamide
CID 119679316
4-amino-N-(2-fluorophenyl)cyclohexane-1-carboxamide
CID 60847748

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide (CID 66030489) is 3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide is NC1CCC(C(=O)Nc2ccccc2I)C1.
What is the InChIKey of 3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide?
The InChIKey is DXUXRBHABOIBIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15IN2O/c13-10-3-1-2-4-11(10)15-12(16)8-5-6-9(14)7-8/h1-4,8-9H,5-7,14H2,(H,15,16).
What are the key properties of 3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide?
3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide has a molecular weight of 330.17 g/mol, XLogP of 2.36, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 66030489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).