(5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine

C9H10BrN3O — CID 130565518

IUPAC(5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine
SMILESNC(C1=CCCO1)c1ncncc1Br
InChIInChI=1S/C9H10BrN3O/c10-6-4-12-5-13-9(6)8(11)7-2-1-3-14-7/h2,4-5,8H,1,3,11H2
InChIKeyGANPZZDIWNAHKD-UHFFFAOYSA-N
MW256.10 g/mol
LogP1.54
Rot. Bonds2

About (5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine

(5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine (PubChem CID 130565518) has the molecular formula C9H10BrN3O and a molecular weight of 256.10 g/mol. Its IUPAC name is (5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine.

Molecular Properties

Compound Name(5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine
PubChem CID130565518
Molecular FormulaC9H10BrN3O
Molecular Weight256.10 g/mol
Exact Mass255.00
IUPAC Name(5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine
SMILESNC(C1=CCCO1)c1ncncc1Br
InChIInChI=1S/C9H10BrN3O/c10-6-4-12-5-13-9(6)8(11)7-2-1-3-14-7/h2,4-5,8H,1,3,11H2
InChIKeyGANPZZDIWNAHKD-UHFFFAOYSA-N
XLogP1.54
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.10
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine?
The IUPAC name of (5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine (CID 130565518) is (5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine.
What is the SMILES notation for (5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine?
The canonical SMILES for (5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine is NC(C1=CCCO1)c1ncncc1Br.
What is the InChIKey of (5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine?
The InChIKey is GANPZZDIWNAHKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrN3O/c10-6-4-12-5-13-9(6)8(11)7-2-1-3-14-7/h2,4-5,8H,1,3,11H2.
What are the key properties of (5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine?
(5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine has a molecular weight of 256.10 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromopyrimidin-4-yl)-(2,3-dihydrofuran-5-yl)methanamine is sourced from PubChem (CID 130565518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).