N-(4-iodophenyl)quinoline-6-carboxamide

C16H11IN2O — CID 60723213

IUPACN-(4-iodophenyl)quinoline-6-carboxamide
SMILESO=C(Nc1ccc(I)cc1)c1ccc2ncccc2c1
InChIInChI=1S/C16H11IN2O/c17-13-4-6-14(7-5-13)19-16(20)12-3-8-15-11(10-12)2-1-9-18-15/h1-10H,(H,19,20)
InChIKeySUQJNFGAYCQIOJ-UHFFFAOYSA-N
MW374.18 g/mol
LogP4.09
Rot. Bonds2

About N-(4-iodophenyl)quinoline-6-carboxamide

N-(4-iodophenyl)quinoline-6-carboxamide (PubChem CID 60723213) has the molecular formula C16H11IN2O and a molecular weight of 374.18 g/mol. Its IUPAC name is N-(4-iodophenyl)quinoline-6-carboxamide.

Molecular Properties

Compound NameN-(4-iodophenyl)quinoline-6-carboxamide
PubChem CID60723213
Molecular FormulaC16H11IN2O
Molecular Weight374.18 g/mol
Exact Mass373.99
IUPAC NameN-(4-iodophenyl)quinoline-6-carboxamide
SMILESO=C(Nc1ccc(I)cc1)c1ccc2ncccc2c1
InChIInChI=1S/C16H11IN2O/c17-13-4-6-14(7-5-13)19-16(20)12-3-8-15-11(10-12)2-1-9-18-15/h1-10H,(H,19,20)
InChIKeySUQJNFGAYCQIOJ-UHFFFAOYSA-N
XLogP4.09
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.18
LogP ≤ 54.09
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-pyridin-4-ylquinoline-6-carboxamide
CID 53313330
N-quinolin-6-ylbenzamide
CID 833617
N-(3-amino-4-bromophenyl)quinoline-6-carboxamide
CID 79754299
N-(3-bromo-4-fluorophenyl)quinoline-6-carboxamide
CID 115661425
N-quinolin-6-yl-2H-benzotriazole-5-carboxamide
CID 60555981
N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide
CID 18422129
N-quinolin-6-yl-3-sulfanylbenzamide
CID 107028522
aniline;molecular hydrogen;N-(4-sulfanylphenyl)quinoline-6-carboxamide;dihydrate
CID 162520932
3,5-dibromo-N-quinolin-6-ylbenzamide
CID 107980427
6-amino-N-quinolin-6-ylpyridine-3-carboxamide
CID 62642214
N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide
CID 86874562
2-hydrazinyl-N-quinolin-6-ylpyridine-4-carboxamide
CID 62640418

Frequently Asked Questions

What is the IUPAC name of N-(4-iodophenyl)quinoline-6-carboxamide?
The IUPAC name of N-(4-iodophenyl)quinoline-6-carboxamide (CID 60723213) is N-(4-iodophenyl)quinoline-6-carboxamide.
What is the SMILES notation for N-(4-iodophenyl)quinoline-6-carboxamide?
The canonical SMILES for N-(4-iodophenyl)quinoline-6-carboxamide is O=C(Nc1ccc(I)cc1)c1ccc2ncccc2c1.
What is the InChIKey of N-(4-iodophenyl)quinoline-6-carboxamide?
The InChIKey is SUQJNFGAYCQIOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11IN2O/c17-13-4-6-14(7-5-13)19-16(20)12-3-8-15-11(10-12)2-1-9-18-15/h1-10H,(H,19,20).
What are the key properties of N-(4-iodophenyl)quinoline-6-carboxamide?
N-(4-iodophenyl)quinoline-6-carboxamide has a molecular weight of 374.18 g/mol, XLogP of 4.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-iodophenyl)quinoline-6-carboxamide is sourced from PubChem (CID 60723213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).