8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine

C18H19N3 — CID 64983358

IUPAC8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine
SMILESCc1cccc2c(N)nc(-c3ccc(C(C)C)cc3)nc12
InChIInChI=1S/C18H19N3/c1-11(2)13-7-9-14(10-8-13)18-20-16-12(3)5-4-6-15(16)17(19)21-18/h4-11H,1-3H3,(H2,19,20,21)
InChIKeyUMXUIPIEJGJGAN-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.31
Rot. Bonds2

About 8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine

8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine (PubChem CID 64983358) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is 8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine.

Molecular Properties

Compound Name8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine
PubChem CID64983358
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine
SMILESCc1cccc2c(N)nc(-c3ccc(C(C)C)cc3)nc12
InChIInChI=1S/C18H19N3/c1-11(2)13-7-9-14(10-8-13)18-20-16-12(3)5-4-6-15(16)17(19)21-18/h4-11H,1-3H3,(H2,19,20,21)
InChIKeyUMXUIPIEJGJGAN-UHFFFAOYSA-N
XLogP4.31
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-8-methylquinazolin-4-amine
CID 64983313
2-(3-chloro-2-methylphenyl)-8-methylquinazolin-4-amine
CID 107100374
2-(3-chloro-4-methylthiophen-2-yl)-8-methylquinazolin-4-amine
CID 103406366
6-bromo-2-(4-propan-2-ylphenyl)quinazolin-4-amine
CID 64983259
2-(2-methoxyphenyl)-8-methylquinazolin-4-amine
CID 64983688
8-methyl-2-propan-2-ylquinolin-4-amine
CID 62198205
4-chloro-8-methylquinazolin-2-amine
CID 10035504
8-methyl-2-(1,1,2,2,2-pentafluoroethyl)quinazolin-4-amine
CID 64983638
5-bromo-6-(methoxymethyl)-2-(4-propan-2-ylphenyl)pyrimidin-4-amine
CID 66298593
6,8-dichloro-2-(3-chloro-4-methylphenyl)quinazolin-4-amine
CID 64983474
(8-methyl-2-propan-2-ylquinolin-4-yl)methanamine
CID 82447883
4-chloro-8-methyl-2-propan-2-ylquinoline
CID 43668842

Frequently Asked Questions

What is the IUPAC name of 8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine?
The IUPAC name of 8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine (CID 64983358) is 8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine.
What is the SMILES notation for 8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine?
The canonical SMILES for 8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine is Cc1cccc2c(N)nc(-c3ccc(C(C)C)cc3)nc12.
What is the InChIKey of 8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine?
The InChIKey is UMXUIPIEJGJGAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-11(2)13-7-9-14(10-8-13)18-20-16-12(3)5-4-6-15(16)17(19)21-18/h4-11H,1-3H3,(H2,19,20,21).
What are the key properties of 8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine?
8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine has a molecular weight of 277.37 g/mol, XLogP of 4.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-(4-propan-2-ylphenyl)quinazolin-4-amine is sourced from PubChem (CID 64983358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).