8-chloro-N-(4-methoxyphenyl)quinolin-4-amine

C16H13ClN2O — CID 43833259

IUPAC8-chloro-N-(4-methoxyphenyl)quinolin-4-amine
SMILESCOc1ccc(Nc2ccnc3c(Cl)cccc23)cc1
InChIInChI=1S/C16H13ClN2O/c1-20-12-7-5-11(6-8-12)19-15-9-10-18-16-13(15)3-2-4-14(16)17/h2-10H,1H3,(H,18,19)
InChIKeyBQNIGOPFWFVTHO-UHFFFAOYSA-N
MW284.75 g/mol
LogP4.64
Rot. Bonds3

About 8-chloro-N-(4-methoxyphenyl)quinolin-4-amine

8-chloro-N-(4-methoxyphenyl)quinolin-4-amine (PubChem CID 43833259) has the molecular formula C16H13ClN2O and a molecular weight of 284.75 g/mol. Its IUPAC name is 8-chloro-N-(4-methoxyphenyl)quinolin-4-amine.

Molecular Properties

Compound Name8-chloro-N-(4-methoxyphenyl)quinolin-4-amine
PubChem CID43833259
Molecular FormulaC16H13ClN2O
Molecular Weight284.75 g/mol
Exact Mass284.07
IUPAC Name8-chloro-N-(4-methoxyphenyl)quinolin-4-amine
SMILESCOc1ccc(Nc2ccnc3c(Cl)cccc23)cc1
InChIInChI=1S/C16H13ClN2O/c1-20-12-7-5-11(6-8-12)19-15-9-10-18-16-13(15)3-2-4-14(16)17/h2-10H,1H3,(H,18,19)
InChIKeyBQNIGOPFWFVTHO-UHFFFAOYSA-N
XLogP4.64
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.75
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-chloro-N-(2-methoxyphenyl)quinolin-4-amine
CID 43833261
4-N-(2-chloro-5-methoxyphenyl)quinoline-4,8-diamine
CID 83065865
N-(2-bromophenyl)-8-chloroquinolin-4-amine
CID 43832738
7-chloro-N-(4-methoxyphenyl)quinolin-4-amine;ethane
CID 153341767
N-(4-chlorophenyl)-8-fluoroquinolin-4-amine
CID 43833203
4-(4-chloroanilino)quinolin-8-ol
CID 152720293
1-[2-[(8-chloroquinolin-4-yl)amino]phenyl]ethanone
CID 43832784
8-chloro-N-ethylquinolin-4-amine
CID 62190462
(8-chloroquinolin-4-yl)hydrazine;hydrochloride
CID 43865977
N-(3-chloro-2-methylphenyl)-7-methoxyquinolin-4-amine
CID 50877911
7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine
CID 43860071
7-chloro-N-(4-chlorophenyl)-8-methylquinolin-4-amine
CID 43860092

Frequently Asked Questions

What is the IUPAC name of 8-chloro-N-(4-methoxyphenyl)quinolin-4-amine?
The IUPAC name of 8-chloro-N-(4-methoxyphenyl)quinolin-4-amine (CID 43833259) is 8-chloro-N-(4-methoxyphenyl)quinolin-4-amine.
What is the SMILES notation for 8-chloro-N-(4-methoxyphenyl)quinolin-4-amine?
The canonical SMILES for 8-chloro-N-(4-methoxyphenyl)quinolin-4-amine is COc1ccc(Nc2ccnc3c(Cl)cccc23)cc1.
What is the InChIKey of 8-chloro-N-(4-methoxyphenyl)quinolin-4-amine?
The InChIKey is BQNIGOPFWFVTHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN2O/c1-20-12-7-5-11(6-8-12)19-15-9-10-18-16-13(15)3-2-4-14(16)17/h2-10H,1H3,(H,18,19).
What are the key properties of 8-chloro-N-(4-methoxyphenyl)quinolin-4-amine?
8-chloro-N-(4-methoxyphenyl)quinolin-4-amine has a molecular weight of 284.75 g/mol, XLogP of 4.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-N-(4-methoxyphenyl)quinolin-4-amine is sourced from PubChem (CID 43833259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).