7-chloro-N-(3-methoxyphenyl)quinolin-4-amine

C16H13ClN2O — CID 50877151

IUPAC7-chloro-N-(3-methoxyphenyl)quinolin-4-amine
SMILESCOc1cccc(Nc2ccnc3cc(Cl)ccc23)c1
InChIInChI=1S/C16H13ClN2O/c1-20-13-4-2-3-12(10-13)19-15-7-8-18-16-9-11(17)5-6-14(15)16/h2-10H,1H3,(H,18,19)
InChIKeyHQGLYOXXMBFTMF-UHFFFAOYSA-N
MW284.75 g/mol
LogP4.64
Rot. Bonds3

About 7-chloro-N-(3-methoxyphenyl)quinolin-4-amine

7-chloro-N-(3-methoxyphenyl)quinolin-4-amine (PubChem CID 50877151) has the molecular formula C16H13ClN2O and a molecular weight of 284.75 g/mol. Its IUPAC name is 7-chloro-N-(3-methoxyphenyl)quinolin-4-amine.

Molecular Properties

Compound Name7-chloro-N-(3-methoxyphenyl)quinolin-4-amine
PubChem CID50877151
Molecular FormulaC16H13ClN2O
Molecular Weight284.75 g/mol
Exact Mass284.07
IUPAC Name7-chloro-N-(3-methoxyphenyl)quinolin-4-amine
SMILESCOc1cccc(Nc2ccnc3cc(Cl)ccc23)c1
InChIInChI=1S/C16H13ClN2O/c1-20-13-4-2-3-12(10-13)19-15-7-8-18-16-9-11(17)5-6-14(15)16/h2-10H,1H3,(H,18,19)
InChIKeyHQGLYOXXMBFTMF-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

7-chloro-N-(4-methoxyphenyl)quinolin-4-amine;ethane
CID 153341767
6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine
CID 53264717
7-methoxy-N-(3-methylphenyl)quinolin-4-amine
CID 50877899
3-[(7-chloroquinolin-4-yl)amino]phenol
CID 15654508
3-[(7-chloroquinolin-4-yl)amino]phenol;hydrochloride
CID 24884898
7-chloro-N-(2,6-dimethylphenyl)quinolin-4-amine
CID 134151417
4-(3-chloroanilino)-7-methoxyquinolin-6-ol
CID 25000015
N-(3-chloro-2-methylphenyl)-7-methoxyquinolin-4-amine
CID 50877911
N-[4-[6-amino-4-(4-methoxyphenyl)-2-pyridinyl]phenyl]-7-chloroquinolin-4-amine
CID 10766086
7-chloro-N-[3-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]quinolin-4-amine
CID 53363392
N-[3-[(1S)-1-[bis(2-chloroethyl)amino]ethyl]phenyl]-7-chloroquinolin-4-amine
CID 98505185
N-(3-fluorophenyl)-7-methoxyquinolin-4-amine;N-propylthiohydroxylamine
CID 168886783

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-(3-methoxyphenyl)quinolin-4-amine?
The IUPAC name of 7-chloro-N-(3-methoxyphenyl)quinolin-4-amine (CID 50877151) is 7-chloro-N-(3-methoxyphenyl)quinolin-4-amine.
What is the SMILES notation for 7-chloro-N-(3-methoxyphenyl)quinolin-4-amine?
The canonical SMILES for 7-chloro-N-(3-methoxyphenyl)quinolin-4-amine is COc1cccc(Nc2ccnc3cc(Cl)ccc23)c1.
What is the InChIKey of 7-chloro-N-(3-methoxyphenyl)quinolin-4-amine?
The InChIKey is HQGLYOXXMBFTMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN2O/c1-20-13-4-2-3-12(10-13)19-15-7-8-18-16-9-11(17)5-6-14(15)16/h2-10H,1H3,(H,18,19).
What are the key properties of 7-chloro-N-(3-methoxyphenyl)quinolin-4-amine?
7-chloro-N-(3-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 7-chloro-N-(3-methoxyphenyl)quinolin-4-amine is sourced from PubChem (CID 50877151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).