2-chloro-4-quinolin-8-ylaniline

C15H11ClN2 — CID 107607720

IUPAC2-chloro-4-quinolin-8-ylaniline
SMILESNc1ccc(-c2cccc3cccnc23)cc1Cl
InChIInChI=1S/C15H11ClN2/c16-13-9-11(6-7-14(13)17)12-5-1-3-10-4-2-8-18-15(10)12/h1-9H,17H2
InChIKeyDRHNKMLNOISMLO-UHFFFAOYSA-N
MW254.72 g/mol
LogP4.14
Rot. Bonds1

About 2-chloro-4-quinolin-8-ylaniline

2-chloro-4-quinolin-8-ylaniline (PubChem CID 107607720) has the molecular formula C15H11ClN2 and a molecular weight of 254.72 g/mol. Its IUPAC name is 2-chloro-4-quinolin-8-ylaniline.

Molecular Properties

Compound Name2-chloro-4-quinolin-8-ylaniline
PubChem CID107607720
Molecular FormulaC15H11ClN2
Molecular Weight254.72 g/mol
Exact Mass254.06
IUPAC Name2-chloro-4-quinolin-8-ylaniline
SMILESNc1ccc(-c2cccc3cccnc23)cc1Cl
InChIInChI=1S/C15H11ClN2/c16-13-9-11(6-7-14(13)17)12-5-1-3-10-4-2-8-18-15(10)12/h1-9H,17H2
InChIKeyDRHNKMLNOISMLO-UHFFFAOYSA-N
XLogP4.14
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.72
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-5-quinolin-8-ylaniline
CID 81224974
2-fluoro-4-quinolin-8-ylaniline
CID 81224973
8-(3-quinolin-8-ylphenyl)quinoline
CID 90955641
8-(2,4,6-trichlorophenyl)quinoline
CID 126516412
2-chloroaniline;quinolin-8-ol
CID 70504979
8-[3-(3-iodophenyl)phenyl]quinoline
CID 134445646
(6-quinolin-8-ylquinolin-2-yl)methanamine
CID 152669840
8-(2-methylbenzotriazol-5-yl)quinoline
CID 140989740
5-methyl-2-quinolin-8-ylpyridin-3-amine
CID 114050997
mercury;8-phenylquinoline;hydrate
CID 174770535
N-(4-amino-3-chlorophenyl)quinoline-8-carboxamide
CID 82863638
8-[2-(3-methylphenyl)phenyl]quinoline
CID 134445651

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-quinolin-8-ylaniline?
The IUPAC name of 2-chloro-4-quinolin-8-ylaniline (CID 107607720) is 2-chloro-4-quinolin-8-ylaniline.
What is the SMILES notation for 2-chloro-4-quinolin-8-ylaniline?
The canonical SMILES for 2-chloro-4-quinolin-8-ylaniline is Nc1ccc(-c2cccc3cccnc23)cc1Cl.
What is the InChIKey of 2-chloro-4-quinolin-8-ylaniline?
The InChIKey is DRHNKMLNOISMLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2/c16-13-9-11(6-7-14(13)17)12-5-1-3-10-4-2-8-18-15(10)12/h1-9H,17H2.
What are the key properties of 2-chloro-4-quinolin-8-ylaniline?
2-chloro-4-quinolin-8-ylaniline has a molecular weight of 254.72 g/mol, XLogP of 4.14, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-quinolin-8-ylaniline is sourced from PubChem (CID 107607720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).