N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide

C15H20INO2 — CID 106011699

IUPACN-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide
SMILESO=C(NCCCC1CCCC1)c1cc(I)ccc1O
InChIInChI=1S/C15H20INO2/c16-12-7-8-14(18)13(10-12)15(19)17-9-3-6-11-4-1-2-5-11/h7-8,10-11,18H,1-6,9H2,(H,17,19)
InChIKeyHJGQXTJORLSZSK-UHFFFAOYSA-N
MW373.23 g/mol
LogP3.70
Rot. Bonds5

About N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide

N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide (PubChem CID 106011699) has the molecular formula C15H20INO2 and a molecular weight of 373.23 g/mol. Its IUPAC name is N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide.

Molecular Properties

Compound NameN-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide
PubChem CID106011699
Molecular FormulaC15H20INO2
Molecular Weight373.23 g/mol
Exact Mass373.05
IUPAC NameN-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide
SMILESO=C(NCCCC1CCCC1)c1cc(I)ccc1O
InChIInChI=1S/C15H20INO2/c16-12-7-8-14(18)13(10-12)15(19)17-9-3-6-11-4-1-2-5-11/h7-8,10-11,18H,1-6,9H2,(H,17,19)
InChIKeyHJGQXTJORLSZSK-UHFFFAOYSA-N
XLogP3.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.23
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-cyclopentylpropyl)-4-iodobenzamide
CID 106012290
2-hydroxy-5-iodo-N-(4,4,4-trifluorobutyl)benzamide
CID 113246125
N-(3-cyclopentylpropyl)-4-fluoro-2-hydroxybenzamide
CID 106011705
2-hydroxy-5-iodo-N-(3,3,3-trifluoropropyl)benzamide
CID 103713631
N-(3-cyclopentylpropyl)-2-fluoro-4-hydroxybenzamide
CID 103940047
2-hydroxy-5-iodo-N-(3-methylsulfonylpropyl)benzamide
CID 113226265
2-amino-N-(3-cyclopentylpropyl)-4-fluorobenzamide
CID 106006269
N-[2-(cyclopenten-1-yl)ethyl]-2-hydroxy-5-iodobenzamide
CID 114153815
N-(3-cyclopentylpropyl)-2-(ethylamino)-4-methylbenzamide
CID 106015467
N-(2-cyclopentylethyl)-4-iodobenzamide
CID 60732288
2-hydroxy-5-iodo-N-[2-(propylamino)ethyl]benzamide
CID 107732069
2-hydroxy-5-iodo-N-(2-pyrrol-1-ylethyl)benzamide
CID 103725448

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide?
The IUPAC name of N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide (CID 106011699) is N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide.
What is the SMILES notation for N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide?
The canonical SMILES for N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide is O=C(NCCCC1CCCC1)c1cc(I)ccc1O.
What is the InChIKey of N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide?
The InChIKey is HJGQXTJORLSZSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20INO2/c16-12-7-8-14(18)13(10-12)15(19)17-9-3-6-11-4-1-2-5-11/h7-8,10-11,18H,1-6,9H2,(H,17,19).
What are the key properties of N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide?
N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide has a molecular weight of 373.23 g/mol, XLogP of 3.70, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentylpropyl)-2-hydroxy-5-iodobenzamide is sourced from PubChem (CID 106011699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).