(5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine

C13H20N4 — CID 58458309

IUPAC(5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESC[C@@H]1CCc2ncnc(N3CCN(C)CC3)c21
InChIInChI=1S/C13H20N4/c1-10-3-4-11-12(10)13(15-9-14-11)17-7-5-16(2)6-8-17/h9-10H,3-8H2,1-2H3/t10-/m1/s1
InChIKeySRQRMYOYCSOKNC-SNVBAGLBSA-N
MW232.33 g/mol
LogP1.28
Rot. Bonds1

About (5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine

(5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine (PubChem CID 58458309) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is (5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine.

Molecular Properties

Compound Name(5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
PubChem CID58458309
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC Name(5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESC[C@@H]1CCc2ncnc(N3CCN(C)CC3)c21
InChIInChI=1S/C13H20N4/c1-10-3-4-11-12(10)13(15-9-14-11)17-7-5-16(2)6-8-17/h9-10H,3-8H2,1-2H3/t10-/m1/s1
InChIKeySRQRMYOYCSOKNC-SNVBAGLBSA-N
XLogP1.28
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(5R)-5-methyl-4-(4-phenylpiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 70812056
(5S)-5-methyl-4-(4-methylpiperazin-1-yl)-5,7-dihydrothieno[3,4-d]pyrimidine
CID 71142946
(2S)-2-(4-chlorophenyl)-1-[4-[(5R)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]propan-1-one
CID 174681736
(2R)-2-(4-chloro-3-fluorophenyl)-1-[4-[(5R)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-3-(4-methylpiperazin-1-yl)propan-1-ol
CID 161011955
5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol
CID 76792501
(2S)-2-[3-fluoro-4-(trifluoromethyl)phenyl]-1-[4-[(5R)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-3-(4-methylpiperazin-1-yl)propan-1-one
CID 70309551
(2R)-2-amino-3-(4-bromophenyl)-1-[4-[(5R)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]propan-1-one
CID 24784357
2-amino-3-(4-bromophenyl)-1-[4-[(5R)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]propan-1-one
CID 143606982
(2R)-2-amino-3-(4-tert-butylphenyl)-1-[4-[(5R)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]propan-1-one
CID 24784609
(5R)-5-methyl-4-[(2S)-2-methylpiperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride
CID 67339039
3-amino-2-(4-chlorophenyl)-3-[4-[(5R)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]propanal;dihydrochloride
CID 87656478
N-(2-aminoethyl)-N-(4-chlorophenyl)-4-[(5R)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazine-1-carboxamide
CID 25171405

Frequently Asked Questions

What is the IUPAC name of (5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The IUPAC name of (5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine (CID 58458309) is (5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine.
What is the SMILES notation for (5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The canonical SMILES for (5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine is C[C@@H]1CCc2ncnc(N3CCN(C)CC3)c21.
What is the InChIKey of (5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The InChIKey is SRQRMYOYCSOKNC-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H20N4/c1-10-3-4-11-12(10)13(15-9-14-11)17-7-5-16(2)6-8-17/h9-10H,3-8H2,1-2H3/t10-/m1/s1.
What are the key properties of (5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
(5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine has a molecular weight of 232.33 g/mol, XLogP of 1.28, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine is sourced from PubChem (CID 58458309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).