2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine

C11H14N6 — CID 175939042

IUPAC2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine
SMILESNc1nc(N2CCNCC2)nc2cnccc12
InChIInChI=1S/C11H14N6/c12-10-8-1-2-14-7-9(8)15-11(16-10)17-5-3-13-4-6-17/h1-2,7,13H,3-6H2,(H2,12,15,16)
InChIKeyGNAWIDBHLRWXOF-UHFFFAOYSA-N
MW230.27 g/mol
LogP0.02
Rot. Bonds1

About 2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine

2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine (PubChem CID 175939042) has the molecular formula C11H14N6 and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine
PubChem CID175939042
Molecular FormulaC11H14N6
Molecular Weight230.27 g/mol
Exact Mass230.13
IUPAC Name2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine
SMILESNc1nc(N2CCNCC2)nc2cnccc12
InChIInChI=1S/C11H14N6/c12-10-8-1-2-14-7-9(8)15-11(16-10)17-5-3-13-4-6-17/h1-2,7,13H,3-6H2,(H2,12,15,16)
InChIKeyGNAWIDBHLRWXOF-UHFFFAOYSA-N
XLogP0.02
TPSA79.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine with MolForge

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

Launch Full Analysis

Related Compounds

6,7-dimethyl-2-piperazin-1-ylquinazolin-4-amine
CID 158357894
bis(6,7,8-trimethoxy-2-piperazin-1-ylquinazolin-4-amine);hydrate
CID 70479861
2-piperazin-1-yl-6-propylthieno[2,3-d]pyrimidin-4-amine
CID 70537326
8-piperazin-1-ylisoquinoline
CID 21070960
4-(1,4-diazepan-1-yl)pyridin-3-amine
CID 89066011
2-(4-phenylpiperazin-1-yl)quinazolin-4-amine;hydrochloride
CID 52995741
2-(4-pyridin-2-ylpiperazin-1-yl)quinazolin-4-amine
CID 4907991
4-imidazol-1-yl-6-piperazin-1-yl-1,3,5-triazin-2-amine
CID 80837289
2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 12602894
3-piperazin-1-yl-5-(1H-pyrrolo[2,3-c]pyridin-3-ylmethyl)-1,2,4-oxadiazole
CID 167823064
1-(3-methyl-4-pyridinyl)piperazine;dihydrochloride
CID 154825583
2-piperazin-1-yl-4,6-di(piperidin-1-yl)-1,3,5-triazine
CID 655485

Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine?
The IUPAC name of 2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine (CID 175939042) is 2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine is Nc1nc(N2CCNCC2)nc2cnccc12.
What is the InChIKey of 2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine?
The InChIKey is GNAWIDBHLRWXOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6/c12-10-8-1-2-14-7-9(8)15-11(16-10)17-5-3-13-4-6-17/h1-2,7,13H,3-6H2,(H2,12,15,16).
What are the key properties of 2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine?
2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine has a molecular weight of 230.27 g/mol, XLogP of 0.02, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-ylpyrido[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 175939042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).