8-bromopyrido[3,2-d]pyrimidin-4-amine

C7H5BrN4 — CID 172552100

IUPAC8-bromopyrido[3,2-d]pyrimidin-4-amine
SMILESNc1ncnc2c(Br)ccnc12
InChIInChI=1S/C7H5BrN4/c8-4-1-2-10-6-5(4)11-3-12-7(6)9/h1-3H,(H2,9,11,12)
InChIKeyAYJWWDBRGVYKKI-UHFFFAOYSA-N
MW225.05 g/mol
LogP1.37
Rot. Bonds

About 8-bromopyrido[3,2-d]pyrimidin-4-amine

8-bromopyrido[3,2-d]pyrimidin-4-amine (PubChem CID 172552100) has the molecular formula C7H5BrN4 and a molecular weight of 225.05 g/mol. Its IUPAC name is 8-bromopyrido[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name8-bromopyrido[3,2-d]pyrimidin-4-amine
PubChem CID172552100
Molecular FormulaC7H5BrN4
Molecular Weight225.05 g/mol
Exact Mass223.97
IUPAC Name8-bromopyrido[3,2-d]pyrimidin-4-amine
SMILESNc1ncnc2c(Br)ccnc12
InChIInChI=1S/C7H5BrN4/c8-4-1-2-10-6-5(4)11-3-12-7(6)9/h1-3H,(H2,9,11,12)
InChIKeyAYJWWDBRGVYKKI-UHFFFAOYSA-N
XLogP1.37
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.05
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-aminopyrido[3,2-d]pyrimidine-8-carboxylic acid
CID 89372882
4,5,8-tribromoquinoline
CID 114764035
acetylene;pyrido[3,2-d]pyrimidin-4-amine
CID 144514772
4-bromo-8-methyl-1,7-naphthyridine
CID 103416470
4-bromo-3-(bromomethyl)pyridin-2-amine
CID 119002131
4,8-dibromo-5-fluoroquinoline
CID 107627841
5,6-dibromopyrimidin-4-amine
CID 130067671
4-bromo-7,8-dichloroquinoline
CID 39346133
1,7-naphthyridin-8-amine
CID 2737037
4,8-dibromo-1,6-naphthyridine
CID 12520140
4,6-dibromo-10-methylpyrido[3,2-g]quinoline
CID 102458232
8-bromo-9-methylpurin-6-amine
CID 822296

Frequently Asked Questions

What is the IUPAC name of 8-bromopyrido[3,2-d]pyrimidin-4-amine?
The IUPAC name of 8-bromopyrido[3,2-d]pyrimidin-4-amine (CID 172552100) is 8-bromopyrido[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 8-bromopyrido[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 8-bromopyrido[3,2-d]pyrimidin-4-amine is Nc1ncnc2c(Br)ccnc12.
What is the InChIKey of 8-bromopyrido[3,2-d]pyrimidin-4-amine?
The InChIKey is AYJWWDBRGVYKKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5BrN4/c8-4-1-2-10-6-5(4)11-3-12-7(6)9/h1-3H,(H2,9,11,12).
What are the key properties of 8-bromopyrido[3,2-d]pyrimidin-4-amine?
8-bromopyrido[3,2-d]pyrimidin-4-amine has a molecular weight of 225.05 g/mol, XLogP of 1.37, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromopyrido[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 172552100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).