N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine

C21H24N2O3 — CID 134913603

IUPACN,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine
SMILESCCN(CC)c1nc2cc(OC)c(OC)cc2cc1Oc1ccccc1
InChIInChI=1S/C21H24N2O3/c1-5-23(6-2)21-20(26-16-10-8-7-9-11-16)13-15-12-18(24-3)19(25-4)14-17(15)22-21/h7-14H,5-6H2,1-4H3
InChIKeyNQUCBRXUPMMYLE-UHFFFAOYSA-N
MW352.43 g/mol
LogP4.89
Rot. Bonds7

About N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine

N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine (PubChem CID 134913603) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine.

Molecular Properties

Compound NameN,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine
PubChem CID134913603
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC NameN,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine
SMILESCCN(CC)c1nc2cc(OC)c(OC)cc2cc1Oc1ccccc1
InChIInChI=1S/C21H24N2O3/c1-5-23(6-2)21-20(26-16-10-8-7-9-11-16)13-15-12-18(24-3)19(25-4)14-17(15)22-21/h7-14H,5-6H2,1-4H3
InChIKeyNQUCBRXUPMMYLE-UHFFFAOYSA-N
XLogP4.89
TPSA43.82 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4,5-dimethoxy-2-phenoxyphenyl)-4,5-dimethoxy-2-phenoxybenzene
CID 11419749
N-[2-(diethylamino)ethyl]-N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-2-phenoxybenzamide;hydrochloride
CID 44926607
4,5-dimethoxy-2-phenoxyaniline
CID 83008509
1-bromo-2-ethyl-5-methoxy-4-phenoxybenzene
CID 168868572
N-[2-(diethylamino)ethyl]-N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-phenoxybenzamide
CID 41346089
N,N-diethyl-2-(4-methoxyphenyl)quinazolin-4-amine
CID 20963147
2-(6,7-dimethoxyquinolin-3-yl)oxyaniline
CID 141479585
3-phenoxy-2-phenylbenzo[g]quinoline
CID 168878050
2-azulen-2-yl-6,7-dimethoxyquinoline
CID 10591430
6,7-dimethoxy-2,3-diphenylquinoxaline
CID 1236458
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-ethylacridin-9-amine
CID 56846683
3-(diethylamino)-N-(3-methoxyphenyl)quinoxaline-2-carboxamide
CID 46365121

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine?
The IUPAC name of N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine (CID 134913603) is N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine.
What is the SMILES notation for N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine?
The canonical SMILES for N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine is CCN(CC)c1nc2cc(OC)c(OC)cc2cc1Oc1ccccc1.
What is the InChIKey of N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine?
The InChIKey is NQUCBRXUPMMYLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-5-23(6-2)21-20(26-16-10-8-7-9-11-16)13-15-12-18(24-3)19(25-4)14-17(15)22-21/h7-14H,5-6H2,1-4H3.
What are the key properties of N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine?
N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine has a molecular weight of 352.43 g/mol, XLogP of 4.89, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine is sourced from PubChem (CID 134913603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).