N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide

C24H20N4O3 — CID 17496046

IUPACN'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide
SMILESO=C(CCc1ccccc1O)NNC(=O)c1cc(-c2cccnc2)nc2ccccc12
InChIInChI=1S/C24H20N4O3/c29-22-10-4-1-6-16(22)11-12-23(30)27-28-24(31)19-14-21(17-7-5-13-25-15-17)26-20-9-3-2-8-18(19)20/h1-10,13-15,29H,11-12H2,(H,27,30)(H,28,31)
InChIKeyGYRLTURWALXDBM-UHFFFAOYSA-N
MW412.45 g/mol
LogP3.40
Rot. Bonds5

About N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide

N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide (PubChem CID 17496046) has the molecular formula C24H20N4O3 and a molecular weight of 412.45 g/mol. Its IUPAC name is N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide.

Molecular Properties

Compound NameN'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide
PubChem CID17496046
Molecular FormulaC24H20N4O3
Molecular Weight412.45 g/mol
Exact Mass412.15
IUPAC NameN'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide
SMILESO=C(CCc1ccccc1O)NNC(=O)c1cc(-c2cccnc2)nc2ccccc12
InChIInChI=1S/C24H20N4O3/c29-22-10-4-1-6-16(22)11-12-23(30)27-28-24(31)19-14-21(17-7-5-13-25-15-17)26-20-9-3-2-8-18(19)20/h1-10,13-15,29H,11-12H2,(H,27,30)(H,28,31)
InChIKeyGYRLTURWALXDBM-UHFFFAOYSA-N
XLogP3.40
TPSA104.21 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.45
LogP ≤ 53.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-[3-(4-phenylpiperazin-1-yl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide
CID 27670101
2-(furan-2-yl)-N'-[3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propanoyl]quinoline-4-carbohydrazide
CID 55624697
N-(2-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 39889991
N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 39311131
N'-(3-phenyl-1H-pyrazole-5-carbonyl)-2-pyridin-3-ylquinoline-4-carbohydrazide
CID 27689112
N-methyl-2-pyridin-3-ylquinoline-4-carboxamide
CID 53007972
N-[2-(2-fluorophenyl)ethyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 27847926
N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide
CID 25180097
N-[3-(4-hydroxyphenyl)propyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 86972801
N-[2-(4-methylphenyl)ethyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 4107904
N'-(5-methylthiophene-2-carbonyl)-2-pyridin-3-ylquinoline-4-carbohydrazide
CID 27679654
2-pyridin-3-yl-N-(pyridin-4-ylmethyl)quinoline-4-carboxamide
CID 24538422

Frequently Asked Questions

What is the IUPAC name of N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide?
The IUPAC name of N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide (CID 17496046) is N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide.
What is the SMILES notation for N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide?
The canonical SMILES for N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide is O=C(CCc1ccccc1O)NNC(=O)c1cc(-c2cccnc2)nc2ccccc12.
What is the InChIKey of N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide?
The InChIKey is GYRLTURWALXDBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O3/c29-22-10-4-1-6-16(22)11-12-23(30)27-28-24(31)19-14-21(17-7-5-13-25-15-17)26-20-9-3-2-8-18(19)20/h1-10,13-15,29H,11-12H2,(H,27,30)(H,28,31).
What are the key properties of N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide?
N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide has a molecular weight of 412.45 g/mol, XLogP of 3.40, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[3-(2-hydroxyphenyl)propanoyl]-2-pyridin-3-ylquinoline-4-carbohydrazide is sourced from PubChem (CID 17496046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).