6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine

C18H18N2O3 — CID 53264717

IUPAC6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine
SMILESCOc1cccc(Nc2ccnc3cc(OC)c(OC)cc23)c1
InChIInChI=1S/C18H18N2O3/c1-21-13-6-4-5-12(9-13)20-15-7-8-19-16-11-18(23-3)17(22-2)10-14(15)16/h4-11H,1-3H3,(H,19,20)
InChIKeyXRZMFQQRICVCID-UHFFFAOYSA-N
MW310.35 g/mol
LogP4.00
Rot. Bonds5

About 6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine

6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine (PubChem CID 53264717) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is 6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine.

Molecular Properties

Compound Name6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine
PubChem CID53264717
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine
SMILESCOc1cccc(Nc2ccnc3cc(OC)c(OC)cc23)c1
InChIInChI=1S/C18H18N2O3/c1-21-13-6-4-5-12(9-13)20-15-7-8-19-16-11-18(23-3)17(22-2)10-14(15)16/h4-11H,1-3H3,(H,19,20)
InChIKeyXRZMFQQRICVCID-UHFFFAOYSA-N
XLogP4.00
TPSA52.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6,7-dimethoxy-N-(3-phenoxyphenyl)quinolin-4-amine;N-(3-phenoxyphenyl)quinolin-4-amine;dihydrochloride
CID 67730198
3-[(6,7-dimethoxyquinolin-4-yl)amino]phenol;hydrochloride
CID 22646651
7-chloro-N-(3-methoxyphenyl)quinolin-4-amine
CID 50877151
7-methoxy-N-(3-methylphenyl)quinolin-4-amine
CID 50877899
4-(3-chloroanilino)-7-methoxyquinolin-6-ol
CID 25000015
N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinolin-4-amine
CID 24999709
6,7-dimethoxy-N-(4-naphthalen-2-yloxyphenyl)quinolin-4-amine
CID 166515203
6,7-dimethoxy-N-methylquinolin-4-amine
CID 62190466
N-(1H-indol-4-yl)-6,7-dimethoxyquinolin-4-amine
CID 139921584
4-(3-methoxyanilino)quinoline-6,8-diol;hydrochloride
CID 22417967
N-(4-chloro-2,5-dimethoxyphenyl)-6,7-dimethoxyquinolin-4-amine
CID 53264749
2-[[3-[4-[(6,7-dimethoxyquinolin-4-yl)amino]phenoxy]phenyl]methoxy]benzonitrile
CID 90071525

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine?
The IUPAC name of 6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine (CID 53264717) is 6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine.
What is the SMILES notation for 6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine?
The canonical SMILES for 6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine is COc1cccc(Nc2ccnc3cc(OC)c(OC)cc23)c1.
What is the InChIKey of 6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine?
The InChIKey is XRZMFQQRICVCID-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-21-13-6-4-5-12(9-13)20-15-7-8-19-16-11-18(23-3)17(22-2)10-14(15)16/h4-11H,1-3H3,(H,19,20).
What are the key properties of 6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine?
6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine has a molecular weight of 310.35 g/mol, XLogP of 4.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-N-(3-methoxyphenyl)quinolin-4-amine is sourced from PubChem (CID 53264717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).