2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine

C10H9BrClN3 — CID 84813864

IUPAC2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine
SMILESNCCc1nc(Cl)c2cccc(Br)c2n1
InChIInChI=1S/C10H9BrClN3/c11-7-3-1-2-6-9(7)14-8(4-5-13)15-10(6)12/h1-3H,4-5,13H2
InChIKeyUVIDREBROQKVFC-UHFFFAOYSA-N
MW286.56 g/mol
LogP2.55
Rot. Bonds2

About 2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine

2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine (PubChem CID 84813864) has the molecular formula C10H9BrClN3 and a molecular weight of 286.56 g/mol. Its IUPAC name is 2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine.

Molecular Properties

Compound Name2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine
PubChem CID84813864
Molecular FormulaC10H9BrClN3
Molecular Weight286.56 g/mol
Exact Mass284.97
IUPAC Name2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine
SMILESNCCc1nc(Cl)c2cccc(Br)c2n1
InChIInChI=1S/C10H9BrClN3/c11-7-3-1-2-6-9(7)14-8(4-5-13)15-10(6)12/h1-3H,4-5,13H2
InChIKeyUVIDREBROQKVFC-UHFFFAOYSA-N
XLogP2.55
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.56
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-chloro-8-fluoroquinazolin-2-yl)methanamine
CID 84781950
8-bromo-4,6-dichloro-2-propylquinazoline
CID 106583968
8-bromo-4-chloro-2-(trifluoromethyl)quinazoline
CID 34176296
8-bromo-4-chloro-2-(difluoromethyl)quinazoline
CID 114590784
8-bromo-2-(chloromethyl)quinazolin-4-amine
CID 155601133
8-bromo-4-chloro-6-methyl-2-propylquinazoline
CID 106584204
8-bromo-4-chloro-2-(1,1,2,2,2-pentafluoroethyl)quinazoline
CID 114590811
8-bromo-4-chloro-2-(2,4-difluorophenyl)quinazoline
CID 114590744
8-bromo-4-chloro-2-thiophen-3-ylquinazoline
CID 114590763
(8-bromo-4-chloro-6-methylquinazolin-2-yl)methanol
CID 174656084
8-bromo-2-chloroquinazolin-4-amine;8-bromo-2,4-dichloroquinazoline;oxolane
CID 159859261
2-bromo-4-chloro-8-fluoroquinazoline
CID 84806834

Frequently Asked Questions

What is the IUPAC name of 2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine?
The IUPAC name of 2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine (CID 84813864) is 2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine.
What is the SMILES notation for 2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine?
The canonical SMILES for 2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine is NCCc1nc(Cl)c2cccc(Br)c2n1.
What is the InChIKey of 2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine?
The InChIKey is UVIDREBROQKVFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrClN3/c11-7-3-1-2-6-9(7)14-8(4-5-13)15-10(6)12/h1-3H,4-5,13H2.
What are the key properties of 2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine?
2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine has a molecular weight of 286.56 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-bromo-4-chloroquinazolin-2-yl)ethanamine is sourced from PubChem (CID 84813864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).