6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine

C13H22N6 — CID 67718296

IUPAC6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine
SMILESNc1cc(N2CCNCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C13H22N6/c14-11-10-12(18-8-4-15-5-9-18)17-13(16-11)19-6-2-1-3-7-19/h10,15H,1-9H2,(H2,14,16,17)
InChIKeySXMHQZCVHRPOJX-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.46
Rot. Bonds2

About 6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine

6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine (PubChem CID 67718296) has the molecular formula C13H22N6 and a molecular weight of 262.36 g/mol. Its IUPAC name is 6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine
PubChem CID67718296
Molecular FormulaC13H22N6
Molecular Weight262.36 g/mol
Exact Mass262.19
IUPAC Name6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine
SMILESNc1cc(N2CCNCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C13H22N6/c14-11-10-12(18-8-4-15-5-9-18)17-13(16-11)19-6-2-1-3-7-19/h10,15H,1-9H2,(H2,14,16,17)
InChIKeySXMHQZCVHRPOJX-UHFFFAOYSA-N
XLogP0.46
TPSA70.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-piperazin-1-ylpyrimidine-2,4-diamine
CID 21363888
4-[4-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]-2,6-dipyrrolidin-1-ylpyrimidine
CID 57355688
2-piperazin-1-yl-4,6-di(piperidin-1-yl)-1,3,5-triazine
CID 655485
2-methylsulfanyl-6-piperazin-1-ylpyrimidin-4-amine
CID 77231452
4-piperazin-1-yl-2-piperidin-1-ylpyrimidine
CID 83724540
N-tert-butyl-6-piperazin-1-yl-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 19428533
6-[4-(1H-imidazol-2-yl)piperidin-1-yl]-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 70716303
4-(2-morpholin-4-yl-6-pyrrolidin-1-ylpyrimidin-4-yl)morpholine
CID 67897493
6-piperidin-1-yl-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyrimidin-4-amine
CID 70929943
1-(4-amino-6-piperidin-1-ylpyrimidin-2-yl)-4-sulfanylpyrrolidin-2-one
CID 168710708
4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine
CID 99980092
6-pyrrolidin-1-yl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106770242

Frequently Asked Questions

What is the IUPAC name of 6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine?
The IUPAC name of 6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine (CID 67718296) is 6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine.
What is the SMILES notation for 6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine?
The canonical SMILES for 6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine is Nc1cc(N2CCNCC2)nc(N2CCCCC2)n1.
What is the InChIKey of 6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine?
The InChIKey is SXMHQZCVHRPOJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N6/c14-11-10-12(18-8-4-15-5-9-18)17-13(16-11)19-6-2-1-3-7-19/h10,15H,1-9H2,(H2,14,16,17).
What are the key properties of 6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine?
6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine has a molecular weight of 262.36 g/mol, XLogP of 0.46, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperazin-1-yl-2-piperidin-1-ylpyrimidin-4-amine is sourced from PubChem (CID 67718296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).