N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine

C13H23N5 — CID 61241307

IUPACN-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine
SMILESCCCc1cc(NCCN2CCNCC2)ncn1
InChIInChI=1S/C13H23N5/c1-2-3-12-10-13(17-11-16-12)15-6-9-18-7-4-14-5-8-18/h10-11,14H,2-9H2,1H3,(H,15,16,17)
InChIKeyQRWYHQDQCCFDEW-UHFFFAOYSA-N
MW249.36 g/mol
LogP0.75
Rot. Bonds6

About N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine

N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine (PubChem CID 61241307) has the molecular formula C13H23N5 and a molecular weight of 249.36 g/mol. Its IUPAC name is N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine
PubChem CID61241307
Molecular FormulaC13H23N5
Molecular Weight249.36 g/mol
Exact Mass249.20
IUPAC NameN-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine
SMILESCCCc1cc(NCCN2CCNCC2)ncn1
InChIInChI=1S/C13H23N5/c1-2-3-12-10-13(17-11-16-12)15-6-9-18-7-4-14-5-8-18/h10-11,14H,2-9H2,1H3,(H,15,16,17)
InChIKeyQRWYHQDQCCFDEW-UHFFFAOYSA-N
XLogP0.75
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-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

N-[2-(1-methylpyrazol-4-yl)ethyl]-6-propylpyrimidin-4-amine
CID 80689109
6-ethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]pyrimidin-4-amine
CID 61241263
N-ethyl-N'-(6-propylpyrimidin-4-yl)propane-1,3-diamine
CID 61241880
N-[2-(1-methylimidazol-2-yl)ethyl]-6-propylpyrimidin-4-amine
CID 61242268
N-(2-cyclopentylethyl)-6-propylpyrimidin-4-amine
CID 61241874
N-[(1,4-dimethylpiperidin-4-yl)methyl]-6-propylpyrimidin-4-amine
CID 107164291
N-(4-methylpiperazin-1-yl)-6-propylpyrimidin-4-amine
CID 83025484
6-ethoxy-N-(2-pyrrolidin-1-ylethyl)pyrimidin-4-amine
CID 66330187
N-(3-cyclopentylpropyl)-6-propylpyrimidin-4-amine
CID 106012599
N-(6-propylpyrimidin-4-yl)azepan-4-amine
CID 107173664
6-N-methyl-4-N-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine
CID 80805097
5-fluoro-6-methyl-N-(2-piperazin-1-ylethyl)pyrimidin-4-amine
CID 114045681

Frequently Asked Questions

What is the IUPAC name of N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine?
The IUPAC name of N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine (CID 61241307) is N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine.
What is the SMILES notation for N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine?
The canonical SMILES for N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine is CCCc1cc(NCCN2CCNCC2)ncn1.
What is the InChIKey of N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine?
The InChIKey is QRWYHQDQCCFDEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5/c1-2-3-12-10-13(17-11-16-12)15-6-9-18-7-4-14-5-8-18/h10-11,14H,2-9H2,1H3,(H,15,16,17).
What are the key properties of N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine?
N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 0.75, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperazin-1-ylethyl)-6-propylpyrimidin-4-amine is sourced from PubChem (CID 61241307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).