2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine

C14H25N5 — CID 80945393

IUPAC2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine
SMILESCCCc1nc(N)cc(N2CCN(CCC)CC2)n1
InChIInChI=1S/C14H25N5/c1-3-5-13-16-12(15)11-14(17-13)19-9-7-18(6-4-2)8-10-19/h11H,3-10H2,1-2H3,(H2,15,16,17)
InChIKeyBTSQVIPITWBGMG-UHFFFAOYSA-N
MW263.39 g/mol
LogP1.54
Rot. Bonds5

About 2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine

2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine (PubChem CID 80945393) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is 2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine
PubChem CID80945393
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine
SMILESCCCc1nc(N)cc(N2CCN(CCC)CC2)n1
InChIInChI=1S/C14H25N5/c1-3-5-13-16-12(15)11-14(17-13)19-9-7-18(6-4-2)8-10-19/h11H,3-10H2,1-2H3,(H2,15,16,17)
InChIKeyBTSQVIPITWBGMG-UHFFFAOYSA-N
XLogP1.54
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine?
The IUPAC name of 2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine (CID 80945393) is 2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine?
The canonical SMILES for 2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine is CCCc1nc(N)cc(N2CCN(CCC)CC2)n1.
What is the InChIKey of 2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine?
The InChIKey is BTSQVIPITWBGMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-3-5-13-16-12(15)11-14(17-13)19-9-7-18(6-4-2)8-10-19/h11H,3-10H2,1-2H3,(H2,15,16,17).
What are the key properties of 2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine?
2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine has a molecular weight of 263.39 g/mol, XLogP of 1.54, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 80945393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).