2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine

C18H19N3O2 — CID 132524311

IUPAC2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine
SMILESCOc1ccc(-c2nc(N(C)C)c3ccccc3n2)cc1OC
InChIInChI=1S/C18H19N3O2/c1-21(2)18-13-7-5-6-8-14(13)19-17(20-18)12-9-10-15(22-3)16(11-12)23-4/h5-11H,1-4H3
InChIKeyFRHMLOAYPYYNAZ-UHFFFAOYSA-N
MW309.37 g/mol
LogP3.38
Rot. Bonds4

About 2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine

2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine (PubChem CID 132524311) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine
PubChem CID132524311
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Name2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine
SMILESCOc1ccc(-c2nc(N(C)C)c3ccccc3n2)cc1OC
InChIInChI=1S/C18H19N3O2/c1-21(2)18-13-7-5-6-8-14(13)19-17(20-18)12-9-10-15(22-3)16(11-12)23-4/h5-11H,1-4H3
InChIKeyFRHMLOAYPYYNAZ-UHFFFAOYSA-N
XLogP3.38
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-2-phenylquinazolin-4-amine;ethane
CID 90692707
2-(4-chlorophenyl)-6,7-dimethoxy-N,N-dimethylquinazolin-4-amine
CID 22997395
2-[4-(dimethylamino)quinazolin-2-yl]-4-methylphenol;2-(2-methoxy-5-methylphenyl)-N,N-dimethylquinazolin-4-amine
CID 159938452
2-[4-(diethylamino)phenyl]-N,N-dimethylquinazolin-4-amine
CID 130369805
N-methyl-N,2-diphenylquinazolin-4-amine
CID 10358104
2-(3,4-dimethoxyphenyl)-N-(3,5-dimethylphenyl)quinazolin-4-amine
CID 22330512
N,N-diethyl-2-(4-methoxyphenyl)quinazolin-4-amine
CID 20963147
3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-N,N-dimethyl-5-phenylisoquinolin-1-amine
CID 54759824
N-butan-2-yl-2-(3,4-dimethoxyphenyl)quinazolin-4-amine
CID 23820170
2-(3,4,5-trimethoxyphenyl)quinazolin-4-amine
CID 67327308
2-(4-methoxyphenyl)-4-methylquinazoline
CID 15566164
N,N-dimethyl-2-(1H-pyrrol-2-yl)quinazolin-4-amine
CID 59212834

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine (CID 132524311) is 2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine is COc1ccc(-c2nc(N(C)C)c3ccccc3n2)cc1OC.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine?
The InChIKey is FRHMLOAYPYYNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-21(2)18-13-7-5-6-8-14(13)19-17(20-18)12-9-10-15(22-3)16(11-12)23-4/h5-11H,1-4H3.
What are the key properties of 2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine?
2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine has a molecular weight of 309.37 g/mol, XLogP of 3.38, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-N,N-dimethylquinazolin-4-amine is sourced from PubChem (CID 132524311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).