N-(4-iodophenyl)naphthalene-1-carboxamide

C17H12INO — CID 1019200

IUPACN-(4-iodophenyl)naphthalene-1-carboxamide
SMILESO=C(Nc1ccc(I)cc1)c1cccc2ccccc12
InChIInChI=1S/C17H12INO/c18-13-8-10-14(11-9-13)19-17(20)16-7-3-5-12-4-1-2-6-15(12)16/h1-11H,(H,19,20)
InChIKeyPTWIJGKWVMBGHF-UHFFFAOYSA-N
MW373.19 g/mol
LogP4.70
Rot. Bonds2

About N-(4-iodophenyl)naphthalene-1-carboxamide

N-(4-iodophenyl)naphthalene-1-carboxamide (PubChem CID 1019200) has the molecular formula C17H12INO and a molecular weight of 373.19 g/mol. Its IUPAC name is N-(4-iodophenyl)naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(4-iodophenyl)naphthalene-1-carboxamide
PubChem CID1019200
Molecular FormulaC17H12INO
Molecular Weight373.19 g/mol
Exact Mass373.00
IUPAC NameN-(4-iodophenyl)naphthalene-1-carboxamide
SMILESO=C(Nc1ccc(I)cc1)c1cccc2ccccc12
InChIInChI=1S/C17H12INO/c18-13-8-10-14(11-9-13)19-17(20)16-7-3-5-12-4-1-2-6-15(12)16/h1-11H,(H,19,20)
InChIKeyPTWIJGKWVMBGHF-UHFFFAOYSA-N
XLogP4.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.19
LogP ≤ 54.70
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

1-N,2-N-bis(4-iodophenyl)benzene-1,2-dicarboxamide
CID 2852267
N-[4-(2-phenylethenyl)phenyl]naphthalene-1-carboxamide
CID 23853473
2-iodo-N-(4-iodophenyl)benzamide
CID 3118704
N-(2-iodophenyl)naphthalene-1-carboxamide
CID 11660752
N-(2-chloro-4-iodophenyl)naphthalene-1-carboxamide
CID 1370762
N-[3-chloro-4-(naphthalene-1-carbonylamino)phenyl]naphthalene-1-carboxamide
CID 2179861
N-[4-[(2-methylphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide
CID 2988389
N-(4-phenylmethoxyphenyl)naphthalene-1-carboxamide
CID 1336313
N-(3-fluoro-4-hydroxyphenyl)naphthalene-1-carboxamide
CID 64781251
N-(4-iodophenyl)-1,2-dihydroacenaphthylene-5-carboxamide
CID 23940641
N-[4-(2-aminocyclopropyl)phenyl]naphthalene-1-carboxamide;hydrochloride
CID 170691820
N-[4-(pyrrolidine-1-carbonyl)phenyl]naphthalene-1-carboxamide
CID 2986145

Frequently Asked Questions

What is the IUPAC name of N-(4-iodophenyl)naphthalene-1-carboxamide?
The IUPAC name of N-(4-iodophenyl)naphthalene-1-carboxamide (CID 1019200) is N-(4-iodophenyl)naphthalene-1-carboxamide.
What is the SMILES notation for N-(4-iodophenyl)naphthalene-1-carboxamide?
The canonical SMILES for N-(4-iodophenyl)naphthalene-1-carboxamide is O=C(Nc1ccc(I)cc1)c1cccc2ccccc12.
What is the InChIKey of N-(4-iodophenyl)naphthalene-1-carboxamide?
The InChIKey is PTWIJGKWVMBGHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12INO/c18-13-8-10-14(11-9-13)19-17(20)16-7-3-5-12-4-1-2-6-15(12)16/h1-11H,(H,19,20).
What are the key properties of N-(4-iodophenyl)naphthalene-1-carboxamide?
N-(4-iodophenyl)naphthalene-1-carboxamide has a molecular weight of 373.19 g/mol, XLogP of 4.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-iodophenyl)naphthalene-1-carboxamide is sourced from PubChem (CID 1019200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).