2-(2,6-diethylphenyl)quinazolin-4-amine

C18H19N3 — CID 170413291

IUPAC2-(2,6-diethylphenyl)quinazolin-4-amine
SMILESCCc1cccc(CC)c1-c1nc(N)c2ccccc2n1
InChIInChI=1S/C18H19N3/c1-3-12-8-7-9-13(4-2)16(12)18-20-15-11-6-5-10-14(15)17(19)21-18/h5-11H,3-4H2,1-2H3,(H2,19,20,21)
InChIKeyFIKUWKJGNXKSRW-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.00
Rot. Bonds3

About 2-(2,6-diethylphenyl)quinazolin-4-amine

2-(2,6-diethylphenyl)quinazolin-4-amine (PubChem CID 170413291) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-(2,6-diethylphenyl)quinazolin-4-amine.

Molecular Properties

Compound Name2-(2,6-diethylphenyl)quinazolin-4-amine
PubChem CID170413291
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name2-(2,6-diethylphenyl)quinazolin-4-amine
SMILESCCc1cccc(CC)c1-c1nc(N)c2ccccc2n1
InChIInChI=1S/C18H19N3/c1-3-12-8-7-9-13(4-2)16(12)18-20-15-11-6-5-10-14(15)17(19)21-18/h5-11H,3-4H2,1-2H3,(H2,19,20,21)
InChIKeyFIKUWKJGNXKSRW-UHFFFAOYSA-N
XLogP4.00
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,6-difluoro-3-methylphenyl)quinazolin-4-amine
CID 82816437
2-(4,6-dimethylpyrimidin-2-yl)quinazolin-4-amine
CID 10610759
2-pyrimidin-2-ylquinazolin-4-amine
CID 173199293
5-ethylquinolin-2-amine
CID 59551845
2-(2,6-diethylphenyl)-4-methylquinoline
CID 101498276
2-(4-tert-butylphenyl)quinazolin-4-amine
CID 23762885
2-(3-chloro-5-methylphenyl)quinazolin-4-amine
CID 81324898
2-(3,4,5-trimethoxyphenyl)quinazolin-4-amine
CID 67327308
N-(4-aminoquinazolin-2-yl)-N-methylhydroxylamine
CID 89468446
azane;1-ethylnaphthalene
CID 19048185
2-amino-5-ethyl-4-phenylquinoline-3-carboxylic acid
CID 69016709
2-(2-chloro-4-methylphenyl)quinazolin-4-amine
CID 106863649

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-diethylphenyl)quinazolin-4-amine?
The IUPAC name of 2-(2,6-diethylphenyl)quinazolin-4-amine (CID 170413291) is 2-(2,6-diethylphenyl)quinazolin-4-amine.
What is the SMILES notation for 2-(2,6-diethylphenyl)quinazolin-4-amine?
The canonical SMILES for 2-(2,6-diethylphenyl)quinazolin-4-amine is CCc1cccc(CC)c1-c1nc(N)c2ccccc2n1.
What is the InChIKey of 2-(2,6-diethylphenyl)quinazolin-4-amine?
The InChIKey is FIKUWKJGNXKSRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-3-12-8-7-9-13(4-2)16(12)18-20-15-11-6-5-10-14(15)17(19)21-18/h5-11H,3-4H2,1-2H3,(H2,19,20,21).
What are the key properties of 2-(2,6-diethylphenyl)quinazolin-4-amine?
2-(2,6-diethylphenyl)quinazolin-4-amine has a molecular weight of 277.37 g/mol, XLogP of 4.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-diethylphenyl)quinazolin-4-amine is sourced from PubChem (CID 170413291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).