N-cyclohexyl-2-(2-iodoanilino)propanamide

C15H21IN2O — CID 43083874

IUPACN-cyclohexyl-2-(2-iodoanilino)propanamide
SMILESCC(Nc1ccccc1I)C(=O)NC1CCCCC1
InChIInChI=1S/C15H21IN2O/c1-11(17-14-10-6-5-9-13(14)16)15(19)18-12-7-3-2-4-8-12/h5-6,9-12,17H,2-4,7-8H2,1H3,(H,18,19)
InChIKeyPDDRIVKLACLWBU-UHFFFAOYSA-N
MW372.25 g/mol
LogP3.54
Rot. Bonds4

About N-cyclohexyl-2-(2-iodoanilino)propanamide

N-cyclohexyl-2-(2-iodoanilino)propanamide (PubChem CID 43083874) has the molecular formula C15H21IN2O and a molecular weight of 372.25 g/mol. Its IUPAC name is N-cyclohexyl-2-(2-iodoanilino)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(2-iodoanilino)propanamide
PubChem CID43083874
Molecular FormulaC15H21IN2O
Molecular Weight372.25 g/mol
Exact Mass372.07
IUPAC NameN-cyclohexyl-2-(2-iodoanilino)propanamide
SMILESCC(Nc1ccccc1I)C(=O)NC1CCCCC1
InChIInChI=1S/C15H21IN2O/c1-11(17-14-10-6-5-9-13(14)16)15(19)18-12-7-3-2-4-8-12/h5-6,9-12,17H,2-4,7-8H2,1H3,(H,18,19)
InChIKeyPDDRIVKLACLWBU-UHFFFAOYSA-N
XLogP3.54
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.25
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-cyano-3-methylanilino)-N-cyclohexylpropanamide
CID 107804498
N-cyclopentyl-2-(2,3-difluoroanilino)propanamide
CID 61074672
2-(2-cyano-3-fluoroanilino)-N-cyclopentylpropanamide
CID 43580689
N-cyclohexyl-2-(2-iodoanilino)acetamide
CID 28878262
(2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide
CID 28827851
N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide
CID 18158922
N-cycloheptyl-2-(propan-2-ylamino)benzamide
CID 63107657
(2S)-N-cyclohexyl-2-(2,4-dimethoxyanilino)propanamide
CID 92717913
2-[3-bromo-2-(methoxymethyl)anilino]-N-cyclopentylpropanamide
CID 61165998
N-cyclohexyl-2-(3-fluoroanilino)propanamide
CID 43083427
(2S)-2-(3-acetamidoanilino)-N-cyclohexylpropanamide
CID 40680935
[1-(cyclopentylamino)-1-oxopropan-2-yl] 2-iodobenzoate
CID 3463336

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(2-iodoanilino)propanamide?
The IUPAC name of N-cyclohexyl-2-(2-iodoanilino)propanamide (CID 43083874) is N-cyclohexyl-2-(2-iodoanilino)propanamide.
What is the SMILES notation for N-cyclohexyl-2-(2-iodoanilino)propanamide?
The canonical SMILES for N-cyclohexyl-2-(2-iodoanilino)propanamide is CC(Nc1ccccc1I)C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(2-iodoanilino)propanamide?
The InChIKey is PDDRIVKLACLWBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21IN2O/c1-11(17-14-10-6-5-9-13(14)16)15(19)18-12-7-3-2-4-8-12/h5-6,9-12,17H,2-4,7-8H2,1H3,(H,18,19).
What are the key properties of N-cyclohexyl-2-(2-iodoanilino)propanamide?
N-cyclohexyl-2-(2-iodoanilino)propanamide has a molecular weight of 372.25 g/mol, XLogP of 3.54, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(2-iodoanilino)propanamide is sourced from PubChem (CID 43083874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).