2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine

C20H24N4O2 — CID 74239658

IUPAC2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine
SMILESCOc1cc2nc(-c3cccc(C(C)N(C)C)c3)nc(N)c2cc1OC
InChIInChI=1S/C20H24N4O2/c1-12(24(2)3)13-7-6-8-14(9-13)20-22-16-11-18(26-5)17(25-4)10-15(16)19(21)23-20/h6-12H,1-5H3,(H2,21,22,23)
InChIKeyFOQATOMMTLFGNK-UHFFFAOYSA-N
MW352.44 g/mol
LogP3.52
Rot. Bonds5

About 2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine

2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine (PubChem CID 74239658) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is 2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine.

Molecular Properties

Compound Name2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine
PubChem CID74239658
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC Name2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine
SMILESCOc1cc2nc(-c3cccc(C(C)N(C)C)c3)nc(N)c2cc1OC
InChIInChI=1S/C20H24N4O2/c1-12(24(2)3)13-7-6-8-14(9-13)20-22-16-11-18(26-5)17(25-4)10-15(16)19(21)23-20/h6-12H,1-5H3,(H2,21,22,23)
InChIKeyFOQATOMMTLFGNK-UHFFFAOYSA-N
XLogP3.52
TPSA73.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(3-bromophenyl)-7-methoxyquinazoline-4,6-diamine
CID 90282668
6,7-dimethoxy-2-(4-methylsulfonylphenyl)quinazolin-4-amine
CID 74250739
6,7-dimethoxy-2-(2-methylquinolin-5-yl)quinazolin-4-amine
CID 74250631
2-(3-aminophenyl)-6,7-dimethoxy-N-(3,4,5-trimethoxyphenyl)quinazolin-4-amine
CID 117092365
5-[3-[(1S)-1-(dimethylamino)ethyl]phenyl]pyrimidin-2-amine
CID 39820225
2-(3-methoxyphenyl)-7-methylquinazolin-4-amine
CID 71193032
4-chloro-6,7-dimethoxy-2-(3-methoxyphenyl)quinazoline
CID 57328585
7-fluoro-2-(3-methoxyphenyl)quinazolin-4-amine
CID 64983270
2-(3,4,5-trimethoxyphenyl)quinazolin-4-amine
CID 67327308
6,7-dimethoxy-2-N-[1-(4-methoxyphenyl)ethyl]quinazoline-2,4-diamine
CID 44523304
2-(4-chlorophenyl)-6,7-dimethoxy-N,N-dimethylquinazolin-4-amine
CID 22997395
6-bromo-2-(4-propan-2-ylphenyl)quinazolin-4-amine
CID 64983259

Frequently Asked Questions

What is the IUPAC name of 2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine?
The IUPAC name of 2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine (CID 74239658) is 2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine.
What is the SMILES notation for 2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine?
The canonical SMILES for 2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine is COc1cc2nc(-c3cccc(C(C)N(C)C)c3)nc(N)c2cc1OC.
What is the InChIKey of 2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine?
The InChIKey is FOQATOMMTLFGNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-12(24(2)3)13-7-6-8-14(9-13)20-22-16-11-18(26-5)17(25-4)10-15(16)19(21)23-20/h6-12H,1-5H3,(H2,21,22,23).
What are the key properties of 2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine?
2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine has a molecular weight of 352.44 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[1-(dimethylamino)ethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine is sourced from PubChem (CID 74239658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).