2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide

C23H17N5O2 — CID 175195077

IUPAC2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide
SMILESNc1ccccc1-c1cc(C(=O)Nc2ncc(-c3ccco3)[nH]2)c2ccccc2n1
InChIInChI=1S/C23H17N5O2/c24-17-8-3-1-7-15(17)19-12-16(14-6-2-4-9-18(14)26-19)22(29)28-23-25-13-20(27-23)21-10-5-11-30-21/h1-13H,24H2,(H2,25,27,28,29)
InChIKeyXEAACKMKWNHUOZ-UHFFFAOYSA-N
MW395.42 g/mol
LogP4.72
Rot. Bonds4

About 2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide

2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide (PubChem CID 175195077) has the molecular formula C23H17N5O2 and a molecular weight of 395.42 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide
PubChem CID175195077
Molecular FormulaC23H17N5O2
Molecular Weight395.42 g/mol
Exact Mass395.14
IUPAC Name2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide
SMILESNc1ccccc1-c1cc(C(=O)Nc2ncc(-c3ccco3)[nH]2)c2ccccc2n1
InChIInChI=1S/C23H17N5O2/c24-17-8-3-1-7-15(17)19-12-16(14-6-2-4-9-18(14)26-19)22(29)28-23-25-13-20(27-23)21-10-5-11-30-21/h1-13H,24H2,(H2,25,27,28,29)
InChIKeyXEAACKMKWNHUOZ-UHFFFAOYSA-N
XLogP4.72
TPSA109.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.42
LogP ≤ 54.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[5-(furan-2-yl)-1H-imidazol-2-yl]-2-naphthalen-1-ylquinoline-4-carboxamide
CID 156700857
N-[5-(furan-2-yl)-1H-imidazol-2-yl]-2-phenyl-6-pyridin-3-ylquinoline-4-carboxamide
CID 156700866
2-(2-aminophenyl)quinoline-4-carboxylic acid
CID 131879149
2-(2-fluorophenyl)-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]quinoline-4-carboxamide
CID 67205439
N-(furan-2-ylmethyl)-2-phenylquinoline-4-carboxamide
CID 2188237
2-(furan-2-yl)-N-[4-[4-[[2-(furan-2-yl)quinoline-4-carbonyl]amino]phenoxy]phenyl]quinoline-4-carboxamide
CID 3663828
N-(2,4-dimethylphenyl)-2-(furan-2-yl)quinoline-4-carboxamide
CID 694750
N-(3,5-dimethoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide
CID 9096906
2-(furan-2-yl)-N'-(2-oxo-6-phenyl-1H-pyridine-3-carbonyl)quinoline-4-carbohydrazide
CID 55789537
N-(2-chloro-4-fluorophenyl)-2-(furan-2-yl)quinoline-4-carboxamide
CID 8011201
N-[2-(furan-2-yl)-5-oxo-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-2-phenylquinoline-4-carboxamide
CID 135472206
N-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide
CID 156700846

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide?
The IUPAC name of 2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide (CID 175195077) is 2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide?
The canonical SMILES for 2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide is Nc1ccccc1-c1cc(C(=O)Nc2ncc(-c3ccco3)[nH]2)c2ccccc2n1.
What is the InChIKey of 2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide?
The InChIKey is XEAACKMKWNHUOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N5O2/c24-17-8-3-1-7-15(17)19-12-16(14-6-2-4-9-18(14)26-19)22(29)28-23-25-13-20(27-23)21-10-5-11-30-21/h1-13H,24H2,(H2,25,27,28,29).
What are the key properties of 2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide?
2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide has a molecular weight of 395.42 g/mol, XLogP of 4.72, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-[5-(furan-2-yl)-1H-imidazol-2-yl]quinoline-4-carboxamide is sourced from PubChem (CID 175195077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).