2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride

C10H20Cl2N4 — CID 70398201

IUPAC2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride
SMILESCC1=CC=NC(C)(N2CCNCC2)N1.Cl.Cl
InChIInChI=1S/C10H18N4.2ClH/c1-9-3-4-12-10(2,13-9)14-7-5-11-6-8-14;;/h3-4,11,13H,5-8H2,1-2H3;2*1H
InChIKeyIROYCCTWSMZMSI-UHFFFAOYSA-N
MW267.20 g/mol
LogP0.99
Rot. Bonds1

About 2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride

2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride (PubChem CID 70398201) has the molecular formula C10H20Cl2N4 and a molecular weight of 267.20 g/mol. Its IUPAC name is 2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride.

Molecular Properties

Compound Name2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride
PubChem CID70398201
Molecular FormulaC10H20Cl2N4
Molecular Weight267.20 g/mol
Exact Mass266.11
IUPAC Name2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride
SMILESCC1=CC=NC(C)(N2CCNCC2)N1.Cl.Cl
InChIInChI=1S/C10H18N4.2ClH/c1-9-3-4-12-10(2,13-9)14-7-5-11-6-8-14;;/h3-4,11,13H,5-8H2,1-2H3;2*1H
InChIKeyIROYCCTWSMZMSI-UHFFFAOYSA-N
XLogP0.99
TPSA39.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.20
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride?
The IUPAC name of 2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride (CID 70398201) is 2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride.
What is the SMILES notation for 2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride?
The canonical SMILES for 2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride is CC1=CC=NC(C)(N2CCNCC2)N1.Cl.Cl.
What is the InChIKey of 2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride?
The InChIKey is IROYCCTWSMZMSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4.2ClH/c1-9-3-4-12-10(2,13-9)14-7-5-11-6-8-14;;/h3-4,11,13H,5-8H2,1-2H3;2*1H.
What are the key properties of 2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride?
2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride has a molecular weight of 267.20 g/mol, XLogP of 0.99, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-2-piperazin-1-yl-1H-pyrimidine;dihydrochloride is sourced from PubChem (CID 70398201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).