2-hydroxy-4-(4-iodophenyl)butanamide

C10H12INO2 — CID 154976499

IUPAC2-hydroxy-4-(4-iodophenyl)butanamide
SMILESNC(=O)C(O)CCc1ccc(I)cc1
InChIInChI=1S/C10H12INO2/c11-8-4-1-7(2-5-8)3-6-9(13)10(12)14/h1-2,4-5,9,13H,3,6H2,(H2,12,14)
InChIKeyXBFVXYVVPNYSOV-UHFFFAOYSA-N
MW305.12 g/mol
LogP1.07
Rot. Bonds4

About 2-hydroxy-4-(4-iodophenyl)butanamide

2-hydroxy-4-(4-iodophenyl)butanamide (PubChem CID 154976499) has the molecular formula C10H12INO2 and a molecular weight of 305.12 g/mol. Its IUPAC name is 2-hydroxy-4-(4-iodophenyl)butanamide.

Molecular Properties

Compound Name2-hydroxy-4-(4-iodophenyl)butanamide
PubChem CID154976499
Molecular FormulaC10H12INO2
Molecular Weight305.12 g/mol
Exact Mass304.99
IUPAC Name2-hydroxy-4-(4-iodophenyl)butanamide
SMILESNC(=O)C(O)CCc1ccc(I)cc1
InChIInChI=1S/C10H12INO2/c11-8-4-1-7(2-5-8)3-6-9(13)10(12)14/h1-2,4-5,9,13H,3,6H2,(H2,12,14)
InChIKeyXBFVXYVVPNYSOV-UHFFFAOYSA-N
XLogP1.07
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.12
LogP ≤ 51.07
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

(2R)-2-amino-4-(4-iodophenyl)butanoic acid
CID 172894210
4-(6-ethylnaphthalen-2-yl)-2-hydroxybutanamide
CID 140988588
1-(4-iodophenyl)pentan-3-ol
CID 65476724
2-hydroxy-8-phenyloctanamide
CID 66822616
4-(4-hydroxyphenyl)-2-iodobutanamide
CID 57297993
3-(4-iodophenyl)propanethioic S-acid
CID 18003770
(2S)-2-hydroxy-4-iodobutanamide
CID 143841991
methyl 4-(4-fluorophenyl)-2-hydroxybutanoate
CID 67031210
6-(4-iodophenyl)-2-methylhexan-3-ol
CID 65490172
4-[4-(aminomethyl)phenyl]-2-methylbutanamide
CID 175316753
2-(2-phenylethyl)propanediamide
CID 66660020
4-(4-iodophenyl)butanoic acid
CID 4645427

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-(4-iodophenyl)butanamide?
The IUPAC name of 2-hydroxy-4-(4-iodophenyl)butanamide (CID 154976499) is 2-hydroxy-4-(4-iodophenyl)butanamide.
What is the SMILES notation for 2-hydroxy-4-(4-iodophenyl)butanamide?
The canonical SMILES for 2-hydroxy-4-(4-iodophenyl)butanamide is NC(=O)C(O)CCc1ccc(I)cc1.
What is the InChIKey of 2-hydroxy-4-(4-iodophenyl)butanamide?
The InChIKey is XBFVXYVVPNYSOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12INO2/c11-8-4-1-7(2-5-8)3-6-9(13)10(12)14/h1-2,4-5,9,13H,3,6H2,(H2,12,14).
What are the key properties of 2-hydroxy-4-(4-iodophenyl)butanamide?
2-hydroxy-4-(4-iodophenyl)butanamide has a molecular weight of 305.12 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-(4-iodophenyl)butanamide is sourced from PubChem (CID 154976499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).