N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide

C16H12INOS — CID 68754386

IUPACN-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide
SMILESO=C(Cc1cccc2ccccc12)Nc1ccsc1I
InChIInChI=1S/C16H12INOS/c17-16-14(8-9-20-16)18-15(19)10-12-6-3-5-11-4-1-2-7-13(11)12/h1-9H,10H2,(H,18,19)
InChIKeyMUUXKHOSVNYCAQ-UHFFFAOYSA-N
MW393.25 g/mol
LogP4.69
Rot. Bonds3

About N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide

N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide (PubChem CID 68754386) has the molecular formula C16H12INOS and a molecular weight of 393.25 g/mol. Its IUPAC name is N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide
PubChem CID68754386
Molecular FormulaC16H12INOS
Molecular Weight393.25 g/mol
Exact Mass392.97
IUPAC NameN-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide
SMILESO=C(Cc1cccc2ccccc12)Nc1ccsc1I
InChIInChI=1S/C16H12INOS/c17-16-14(8-9-20-16)18-15(19)10-12-6-3-5-11-4-1-2-7-13(11)12/h1-9H,10H2,(H,18,19)
InChIKeyMUUXKHOSVNYCAQ-UHFFFAOYSA-N
XLogP4.69
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.25
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-ethylphenyl)-2-naphthalen-1-ylacetamide
CID 1228282
2-naphthalen-1-yl-N-[2-(1,3,4-oxadiazol-2-yl)thiophen-3-yl]acetamide
CID 46869071
N-(2-bromophenyl)-2-naphthalen-1-ylacetamide
CID 835456
N-(1-benzothiophen-5-yl)-2-naphthalen-1-ylacetamide
CID 23791200
N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide
CID 1228165
N-[2-methyl-4-[3-methyl-4-[(2-naphthalen-1-ylacetyl)amino]phenyl]phenyl]-2-naphthalen-1-ylacetamide
CID 5046552
2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate
CID 2405590
N-(naphthalen-1-ylmethyl)-2-thiophen-2-ylacetamide
CID 95960121
2-naphthalen-1-yl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]acetamide
CID 7676413
methyl 3-[(2-isoquinolin-5-ylacetyl)amino]thiophene-2-carboxylate
CID 52949817
2-(2-fluorophenyl)-N-naphthalen-1-ylacetamide
CID 836511
N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide
CID 42386767

Frequently Asked Questions

What is the IUPAC name of N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide?
The IUPAC name of N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide (CID 68754386) is N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide is O=C(Cc1cccc2ccccc12)Nc1ccsc1I.
What is the InChIKey of N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide?
The InChIKey is MUUXKHOSVNYCAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12INOS/c17-16-14(8-9-20-16)18-15(19)10-12-6-3-5-11-4-1-2-7-13(11)12/h1-9H,10H2,(H,18,19).
What are the key properties of N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide?
N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide has a molecular weight of 393.25 g/mol, XLogP of 4.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-iodothiophen-3-yl)-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 68754386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).