7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine

C18H17ClN2O2 — CID 43860071

IUPAC7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine
SMILESCOc1ccc(Nc2ccnc3c(C)c(Cl)ccc23)c(OC)c1
InChIInChI=1S/C18H17ClN2O2/c1-11-14(19)6-5-13-15(8-9-20-18(11)13)21-16-7-4-12(22-2)10-17(16)23-3/h4-10H,1-3H3,(H,20,21)
InChIKeyYCUQQQWONIGXEZ-UHFFFAOYSA-N
MW328.80 g/mol
LogP4.96
Rot. Bonds4

About 7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine

7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine (PubChem CID 43860071) has the molecular formula C18H17ClN2O2 and a molecular weight of 328.80 g/mol. Its IUPAC name is 7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine.

Molecular Properties

Compound Name7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine
PubChem CID43860071
Molecular FormulaC18H17ClN2O2
Molecular Weight328.80 g/mol
Exact Mass328.10
IUPAC Name7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine
SMILESCOc1ccc(Nc2ccnc3c(C)c(Cl)ccc23)c(OC)c1
InChIInChI=1S/C18H17ClN2O2/c1-11-14(19)6-5-13-15(8-9-20-18(11)13)21-16-7-4-12(22-2)10-17(16)23-3/h4-10H,1-3H3,(H,20,21)
InChIKeyYCUQQQWONIGXEZ-UHFFFAOYSA-N
XLogP4.96
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.80
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-chloro-N-(4-chlorophenyl)-8-methylquinolin-4-amine
CID 43860092
7-bromo-N-(2,4-dimethoxyphenyl)quinolin-4-amine
CID 50877851
N-(3-chloro-2-methylphenyl)-7-methoxyquinolin-4-amine
CID 50877911
4-N-(2-chloro-5-methoxyphenyl)quinoline-4,8-diamine
CID 83065865
7-chloro-8-methyl-N-(2-methyl-4-nitrophenyl)quinolin-4-amine
CID 43860082
N-(2,4-dimethoxyphenyl)-6-ethylquinolin-4-amine
CID 53264768
4-chloro-7-methoxy-8-methylquinoline
CID 21101954
8-chloro-N-(2-methoxyphenyl)quinolin-4-amine
CID 43833261
8-chloro-N-(4-methoxyphenyl)quinolin-4-amine
CID 43833259
4-[(7-chloro-8-methylquinolin-4-yl)amino]benzoic acid
CID 53269521
2-chloro-4-N-(2,4-dimethoxyphenyl)-5-methylbenzene-1,4-diamine
CID 115554471
3-N-(2,4-dimethoxyphenyl)-4-methylbenzene-1,3-diamine
CID 62588272

Frequently Asked Questions

What is the IUPAC name of 7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine?
The IUPAC name of 7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine (CID 43860071) is 7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine.
What is the SMILES notation for 7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine?
The canonical SMILES for 7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine is COc1ccc(Nc2ccnc3c(C)c(Cl)ccc23)c(OC)c1.
What is the InChIKey of 7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine?
The InChIKey is YCUQQQWONIGXEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2O2/c1-11-14(19)6-5-13-15(8-9-20-18(11)13)21-16-7-4-12(22-2)10-17(16)23-3/h4-10H,1-3H3,(H,20,21).
What are the key properties of 7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine?
7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine has a molecular weight of 328.80 g/mol, XLogP of 4.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N-(2,4-dimethoxyphenyl)-8-methylquinolin-4-amine is sourced from PubChem (CID 43860071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).