N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide

C24H20N4O — CID 3304435

IUPACN-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide
SMILESO=C(NN=CCCc1ccccc1)c1cc(-c2ccccn2)nc2ccccc12
InChIInChI=1S/C24H20N4O/c29-24(28-26-16-8-11-18-9-2-1-3-10-18)20-17-23(22-14-6-7-15-25-22)27-21-13-5-4-12-19(20)21/h1-7,9-10,12-17H,8,11H2,(H,28,29)
InChIKeyVQBQMMWLWREQGQ-UHFFFAOYSA-N
MW380.45 g/mol
LogP4.65
Rot. Bonds6

About N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide

N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide (PubChem CID 3304435) has the molecular formula C24H20N4O and a molecular weight of 380.45 g/mol. Its IUPAC name is N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide
PubChem CID3304435
Molecular FormulaC24H20N4O
Molecular Weight380.45 g/mol
Exact Mass380.16
IUPAC NameN-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide
SMILESO=C(NN=CCCc1ccccc1)c1cc(-c2ccccn2)nc2ccccc12
InChIInChI=1S/C24H20N4O/c29-24(28-26-16-8-11-18-9-2-1-3-10-18)20-17-23(22-14-6-7-15-25-22)27-21-13-5-4-12-19(20)21/h1-7,9-10,12-17H,8,11H2,(H,28,29)
InChIKeyVQBQMMWLWREQGQ-UHFFFAOYSA-N
XLogP4.65
TPSA67.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.45
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2,4-dihydroxyphenyl)methylideneamino]-2-pyridin-2-ylquinoline-4-carboxamide
CID 2327017
N-[(Z)-(3,4-dihydroxyphenyl)methylideneamino]-2-pyridin-2-ylquinoline-4-carboxamide
CID 135730571
N-[(Z)-(3-hydroxyphenyl)methylideneamino]-2-pyridin-2-ylquinoline-4-carboxamide
CID 9078735
N-[(5-bromo-2-hydroxyphenyl)methylideneamino]-2-pyridin-2-ylquinoline-4-carboxamide
CID 2327312
N-[(Z)-[(1R)-cyclohex-3-en-1-yl]methylideneamino]-2-pyridin-2-ylquinoline-4-carboxamide
CID 9078711
N-(4-phenylmethoxyphenyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 1257102
N-ethyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 17473754
N-cyclopropyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 757672
N-(4-carbamoylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 26636560
N-[(Z)-(3-fluoro-4-methoxyphenyl)methylideneamino]-2-pyridin-2-ylquinoline-4-carboxamide
CID 8973347
N-cyclopentyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 4232578
2-pyridin-2-yl-N-[(Z)-1-pyridin-4-ylethylideneamino]quinoline-4-carboxamide
CID 8007643

Frequently Asked Questions

What is the IUPAC name of N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide?
The IUPAC name of N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide (CID 3304435) is N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide.
What is the SMILES notation for N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide?
The canonical SMILES for N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide is O=C(NN=CCCc1ccccc1)c1cc(-c2ccccn2)nc2ccccc12.
What is the InChIKey of N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide?
The InChIKey is VQBQMMWLWREQGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O/c29-24(28-26-16-8-11-18-9-2-1-3-10-18)20-17-23(22-14-6-7-15-25-22)27-21-13-5-4-12-19(20)21/h1-7,9-10,12-17H,8,11H2,(H,28,29).
What are the key properties of N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide?
N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide has a molecular weight of 380.45 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenylpropylideneamino)-2-pyridin-2-ylquinoline-4-carboxamide is sourced from PubChem (CID 3304435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).