1H-indol-3-yl-(4-iodophenyl)methanone

C15H10INO — CID 43339241

IUPAC1H-indol-3-yl-(4-iodophenyl)methanone
SMILESO=C(c1ccc(I)cc1)c1c[nH]c2ccccc12
InChIInChI=1S/C15H10INO/c16-11-7-5-10(6-8-11)15(18)13-9-17-14-4-2-1-3-12(13)14/h1-9,17H
InChIKeyTUPSDOJISRTINE-UHFFFAOYSA-N
MW347.16 g/mol
LogP4.00
Rot. Bonds2

About 1H-indol-3-yl-(4-iodophenyl)methanone

1H-indol-3-yl-(4-iodophenyl)methanone (PubChem CID 43339241) has the molecular formula C15H10INO and a molecular weight of 347.16 g/mol. Its IUPAC name is 1H-indol-3-yl-(4-iodophenyl)methanone.

Molecular Properties

Compound Name1H-indol-3-yl-(4-iodophenyl)methanone
PubChem CID43339241
Molecular FormulaC15H10INO
Molecular Weight347.16 g/mol
Exact Mass346.98
IUPAC Name1H-indol-3-yl-(4-iodophenyl)methanone
SMILESO=C(c1ccc(I)cc1)c1c[nH]c2ccccc12
InChIInChI=1S/C15H10INO/c16-11-7-5-10(6-8-11)15(18)13-9-17-14-4-2-1-3-12(13)14/h1-9,17H
InChIKeyTUPSDOJISRTINE-UHFFFAOYSA-N
XLogP4.00
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.16
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

methyl 4-(1H-indole-3-carbonyl)benzoate
CID 139561809
[4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone
CID 4256394
(3-aminophenyl)-(1H-indol-3-yl)methanone
CID 19024726
1,3-benzodioxol-5-yl(1H-indol-3-yl)methanone
CID 43161266
1H-indol-3-yl-(3-methoxy-4-methylphenyl)methanone
CID 43339248
1H-indole-3-carbonyl chloride;hydrochloride
CID 87937583
(4,6-dichloro-1H-indol-3-yl)-(4-iodophenyl)methanone
CID 103427836
methyl 5-(1H-indole-3-carbonyl)pyridine-2-carboxylate
CID 139570456
(2,6-dichlorophenyl)-(1H-indol-3-yl)methanone
CID 43339266
1H-indol-3-yl(pyridin-2-yl)methanone
CID 3820978
sodium 1H-indole-3-carboxylate
CID 23698293
2,3-bis(1H-indol-3-yl)but-2-enedioic acid
CID 57224094

Frequently Asked Questions

What is the IUPAC name of 1H-indol-3-yl-(4-iodophenyl)methanone?
The IUPAC name of 1H-indol-3-yl-(4-iodophenyl)methanone (CID 43339241) is 1H-indol-3-yl-(4-iodophenyl)methanone.
What is the SMILES notation for 1H-indol-3-yl-(4-iodophenyl)methanone?
The canonical SMILES for 1H-indol-3-yl-(4-iodophenyl)methanone is O=C(c1ccc(I)cc1)c1c[nH]c2ccccc12.
What is the InChIKey of 1H-indol-3-yl-(4-iodophenyl)methanone?
The InChIKey is TUPSDOJISRTINE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10INO/c16-11-7-5-10(6-8-11)15(18)13-9-17-14-4-2-1-3-12(13)14/h1-9,17H.
What are the key properties of 1H-indol-3-yl-(4-iodophenyl)methanone?
1H-indol-3-yl-(4-iodophenyl)methanone has a molecular weight of 347.16 g/mol, XLogP of 4.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-indol-3-yl-(4-iodophenyl)methanone is sourced from PubChem (CID 43339241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).