2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine

C14H22N4 — CID 64876136

IUPAC2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine
SMILESCC1CNC(C)(C2CC2)CN1Cc1ncccn1
InChIInChI=1S/C14H22N4/c1-11-8-17-14(2,12-4-5-12)10-18(11)9-13-15-6-3-7-16-13/h3,6-7,11-12,17H,4-5,8-10H2,1-2H3
InChIKeyWIOPYHSBRKLOQT-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.44
Rot. Bonds3

About 2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine

2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine (PubChem CID 64876136) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is 2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine.

Molecular Properties

Compound Name2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine
PubChem CID64876136
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine
SMILESCC1CNC(C)(C2CC2)CN1Cc1ncccn1
InChIInChI=1S/C14H22N4/c1-11-8-17-14(2,12-4-5-12)10-18(11)9-13-15-6-3-7-16-13/h3,6-7,11-12,17H,4-5,8-10H2,1-2H3
InChIKeyWIOPYHSBRKLOQT-UHFFFAOYSA-N
XLogP1.44
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(5-cyclopropyl-5-methyl-2-propylpiperazin-1-yl)methyl]pyrimidine
CID 64876536
5-cyclopropyl-1-[(2-fluorophenyl)methyl]-2,5-dimethylpiperazine
CID 64875570
3-cyclopropyl-3-methyl-1-(pyrimidin-2-ylmethyl)-1,4-diazepane
CID 64871682
5-cyclopropyl-5-methyl-2-(2-methylpropyl)-1-(pyridin-2-ylmethyl)piperazine
CID 64877133
1-[(5-bromo-2-fluorophenyl)methyl]-5-cyclopropyl-2,5-dimethylpiperazine
CID 64877865
5-cyclopropyl-2,5-dimethyl-1-(4-phenylbutyl)piperazine
CID 114334950
6-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)quinoline
CID 64940952
5-cyclopropyl-2-ethyl-5-methyl-1-(2-pyridin-2-ylethyl)piperazine
CID 64935480
2-[(5-cyclopropyl-2-ethyl-5-methylpiperazin-1-yl)methyl]-1,3-thiazole
CID 64948017
3-[2-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,2,4-oxadiazole
CID 106421427
1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine
CID 114153759
2-[(5,5-diethyl-2-propylpiperazin-1-yl)methyl]pyrimidine
CID 64859659

Frequently Asked Questions

What is the IUPAC name of 2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine?
The IUPAC name of 2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine (CID 64876136) is 2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine.
What is the SMILES notation for 2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine?
The canonical SMILES for 2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine is CC1CNC(C)(C2CC2)CN1Cc1ncccn1.
What is the InChIKey of 2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine?
The InChIKey is WIOPYHSBRKLOQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-11-8-17-14(2,12-4-5-12)10-18(11)9-13-15-6-3-7-16-13/h3,6-7,11-12,17H,4-5,8-10H2,1-2H3.
What are the key properties of 2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine?
2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine has a molecular weight of 246.36 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine is sourced from PubChem (CID 64876136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).