2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide

C13H16INO2 — CID 111432130

IUPAC2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide
SMILESO=C(CC1(O)CCCC1)Nc1cccc(I)c1
InChIInChI=1S/C13H16INO2/c14-10-4-3-5-11(8-10)15-12(16)9-13(17)6-1-2-7-13/h3-5,8,17H,1-2,6-7,9H2,(H,15,16)
InChIKeyNBJLIMNDNRFGFU-UHFFFAOYSA-N
MW345.18 g/mol
LogP2.92
Rot. Bonds3

About 2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide

2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide (PubChem CID 111432130) has the molecular formula C13H16INO2 and a molecular weight of 345.18 g/mol. Its IUPAC name is 2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide.

Molecular Properties

Compound Name2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide
PubChem CID111432130
Molecular FormulaC13H16INO2
Molecular Weight345.18 g/mol
Exact Mass345.02
IUPAC Name2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide
SMILESO=C(CC1(O)CCCC1)Nc1cccc(I)c1
InChIInChI=1S/C13H16INO2/c14-10-4-3-5-11(8-10)15-12(16)9-13(17)6-1-2-7-13/h3-5,8,17H,1-2,6-7,9H2,(H,15,16)
InChIKeyNBJLIMNDNRFGFU-UHFFFAOYSA-N
XLogP2.92
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.18
LogP ≤ 52.92
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

N-(3-fluorophenyl)-2-(1-hydroxycyclopentyl)acetamide
CID 111430420
N-(3-iodophenyl)-2-[1-(sulfanylmethyl)cyclopropyl]acetamide
CID 107022124
2-(1-hydroxycyclopentyl)-N-[3-(methoxymethyl)phenyl]acetamide
CID 111430510
2-chloro-N-(3-iodophenyl)acetamide
CID 2342100
3-(3-iodoanilino)-3-oxopropanoic acid
CID 62230564
1-[[(3-iodophenyl)carbamoylamino]methyl]cyclopentane-1-carboxylic acid
CID 115433937
1-(aminomethyl)-N-(3-iodophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119674707
N-[3-(tert-butylsulfinylmethyl)phenyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111538834
2-(1-hydroxycyclopentyl)-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide
CID 111536432
N-(3-iodophenyl)-3,3-diphenylpropanamide
CID 1297500
2-anilino-N-(3-iodophenyl)acetamide
CID 47107105
4-hydroxy-N-(3-iodophenyl)butanamide
CID 79204561

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide?
The IUPAC name of 2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide (CID 111432130) is 2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide.
What is the SMILES notation for 2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide?
The canonical SMILES for 2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide is O=C(CC1(O)CCCC1)Nc1cccc(I)c1.
What is the InChIKey of 2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide?
The InChIKey is NBJLIMNDNRFGFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16INO2/c14-10-4-3-5-11(8-10)15-12(16)9-13(17)6-1-2-7-13/h3-5,8,17H,1-2,6-7,9H2,(H,15,16).
What are the key properties of 2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide?
2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide has a molecular weight of 345.18 g/mol, XLogP of 2.92, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclopentyl)-N-(3-iodophenyl)acetamide is sourced from PubChem (CID 111432130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).