N-(quinolin-8-ylmethylideneamino)aniline

C16H13N3 — CID 169381691

IUPACN-(quinolin-8-ylmethylideneamino)aniline
SMILESC(=NNc1ccccc1)c1cccc2cccnc12
InChIInChI=1S/C16H13N3/c1-2-9-15(10-3-1)19-18-12-14-7-4-6-13-8-5-11-17-16(13)14/h1-12,19H
InChIKeyAGJLZLYPPAOMMK-UHFFFAOYSA-N
MW247.30 g/mol
LogP3.68
Rot. Bonds3

About N-(quinolin-8-ylmethylideneamino)aniline

N-(quinolin-8-ylmethylideneamino)aniline (PubChem CID 169381691) has the molecular formula C16H13N3 and a molecular weight of 247.30 g/mol. Its IUPAC name is N-(quinolin-8-ylmethylideneamino)aniline.

Molecular Properties

Compound NameN-(quinolin-8-ylmethylideneamino)aniline
PubChem CID169381691
Molecular FormulaC16H13N3
Molecular Weight247.30 g/mol
Exact Mass247.11
IUPAC NameN-(quinolin-8-ylmethylideneamino)aniline
SMILESC(=NNc1ccccc1)c1cccc2cccnc12
InChIInChI=1S/C16H13N3/c1-2-9-15(10-3-1)19-18-12-14-7-4-6-13-8-5-11-17-16(13)14/h1-12,19H
InChIKeyAGJLZLYPPAOMMK-UHFFFAOYSA-N
XLogP3.68
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-N-(quinolin-8-ylmethylideneamino)methanamine
CID 159110850
2-phenyl-N-(quinolin-8-ylmethylideneamino)cyclopropane-1-carboxamide
CID 3594985
N-[[2-(trifluoromethyl)-1H-benzimidazol-4-yl]methylideneamino]aniline
CID 169384028
N-[(6-methylquinolin-5-yl)methylideneamino]aniline
CID 169382791
2-[(2E)-2-[(8-hydroxyquinolin-7-yl)methylidene]hydrazinyl]quinolin-8-ol
CID 135509586
2-(2-methoxyphenoxy)-N-[(Z)-quinolin-8-ylmethylideneamino]acetamide
CID 5413897
2-[2-[(Z)-(quinolin-8-ylhydrazinylidene)methyl]phenoxy]acetate
CID 7640513
N-[(Z)-naphthalen-2-ylmethylideneamino]quinolin-8-amine
CID 7721506
N-[(E)-[(2E)-2-(quinolin-8-ylhydrazinylidene)ethylidene]amino]quinolin-8-amine
CID 6870658
3-quinolin-8-ylprop-2-enal
CID 73158990
N-[(3-chloro-2-iodophenyl)methylideneamino]aniline
CID 169383776
4-fluoro-N-(naphthalen-1-ylmethylideneamino)aniline
CID 78597503

Frequently Asked Questions

What is the IUPAC name of N-(quinolin-8-ylmethylideneamino)aniline?
The IUPAC name of N-(quinolin-8-ylmethylideneamino)aniline (CID 169381691) is N-(quinolin-8-ylmethylideneamino)aniline.
What is the SMILES notation for N-(quinolin-8-ylmethylideneamino)aniline?
The canonical SMILES for N-(quinolin-8-ylmethylideneamino)aniline is C(=NNc1ccccc1)c1cccc2cccnc12.
What is the InChIKey of N-(quinolin-8-ylmethylideneamino)aniline?
The InChIKey is AGJLZLYPPAOMMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3/c1-2-9-15(10-3-1)19-18-12-14-7-4-6-13-8-5-11-17-16(13)14/h1-12,19H.
What are the key properties of N-(quinolin-8-ylmethylideneamino)aniline?
N-(quinolin-8-ylmethylideneamino)aniline has a molecular weight of 247.30 g/mol, XLogP of 3.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(quinolin-8-ylmethylideneamino)aniline is sourced from PubChem (CID 169381691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).