4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride

C11H18Cl2N4 — CID 154583498

IUPAC4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride
SMILESCl.Cl.c1nc2c(c(N3CCNCC3)n1)CCC2
InChIInChI=1S/C11H16N4.2ClH/c1-2-9-10(3-1)13-8-14-11(9)15-6-4-12-5-7-15;;/h8,12H,1-7H2;2*1H
InChIKeyNFGDSURBSZPAEU-UHFFFAOYSA-N
MW277.20 g/mol
LogP1.22
Rot. Bonds1

About 4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride

4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride (PubChem CID 154583498) has the molecular formula C11H18Cl2N4 and a molecular weight of 277.20 g/mol. Its IUPAC name is 4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride.

Molecular Properties

Compound Name4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride
PubChem CID154583498
Molecular FormulaC11H18Cl2N4
Molecular Weight277.20 g/mol
Exact Mass276.09
IUPAC Name4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride
SMILESCl.Cl.c1nc2c(c(N3CCNCC3)n1)CCC2
InChIInChI=1S/C11H16N4.2ClH/c1-2-9-10(3-1)13-8-14-11(9)15-6-4-12-5-7-15;;/h8,12H,1-7H2;2*1H
InChIKeyNFGDSURBSZPAEU-UHFFFAOYSA-N
XLogP1.22
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.20
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride?
The IUPAC name of 4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride (CID 154583498) is 4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride.
What is the SMILES notation for 4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride?
The canonical SMILES for 4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride is Cl.Cl.c1nc2c(c(N3CCNCC3)n1)CCC2.
What is the InChIKey of 4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride?
The InChIKey is NFGDSURBSZPAEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4.2ClH/c1-2-9-10(3-1)13-8-14-11(9)15-6-4-12-5-7-15;;/h8,12H,1-7H2;2*1H.
What are the key properties of 4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride?
4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride has a molecular weight of 277.20 g/mol, XLogP of 1.22, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride is sourced from PubChem (CID 154583498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).