(5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol

C13H20N4O — CID 66617782

IUPAC(5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol
SMILESCC1CNCCN1c1ncnc2c1[C@H](C)C[C@H]2O
InChIInChI=1S/C13H20N4O/c1-8-5-10(18)12-11(8)13(16-7-15-12)17-4-3-14-6-9(17)2/h7-10,14,18H,3-6H2,1-2H3/t8-,9?,10-/m1/s1
InChIKeyRMKIZTORHJPEIJ-RCAUJQPQSA-N
MW248.33 g/mol
LogP0.82
Rot. Bonds1

About (5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol

(5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol (PubChem CID 66617782) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is (5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol.

Molecular Properties

Compound Name(5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol
PubChem CID66617782
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name(5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol
SMILESCC1CNCCN1c1ncnc2c1[C@H](C)C[C@H]2O
InChIInChI=1S/C13H20N4O/c1-8-5-10(18)12-11(8)13(16-7-15-12)17-4-3-14-6-9(17)2/h7-10,14,18H,3-6H2,1-2H3/t8-,9?,10-/m1/s1
InChIKeyRMKIZTORHJPEIJ-RCAUJQPQSA-N
XLogP0.82
TPSA61.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5R)-5-methyl-4-[(2S)-2-methylpiperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine;dihydrochloride
CID 67339039
(5S)-5-methyl-4-[(2S)-2-methylpiperazin-1-yl]-5,7-dihydrothieno[3,4-d]pyrimidine
CID 67459798
5-methyl-4-(4-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol
CID 76792501
(7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol
CID 68735699
4-(2-methylpiperazin-1-yl)quinazoline
CID 62673888
5-bromo-4-(2-methylpiperazin-1-yl)pyrimidine
CID 66340193
[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-methylborinic acid
CID 123308397
1-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]-1,4-diazepan-1-yl]ethanone
CID 58465363
2-(2-methylpiperazin-1-yl)pyrimidin-5-ol
CID 67037782
2-[(2R)-2-methylpiperazin-1-yl]pyridine-3-carbonitrile
CID 94546211
1-(3-methoxy-2-pyridinyl)-2-methylpiperazine;hydrochloride
CID 162079828
4-[(2R)-2-methylpiperazin-1-yl]-6-pyrrolidin-1-ylpyrimidine
CID 98042461

Frequently Asked Questions

What is the IUPAC name of (5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol?
The IUPAC name of (5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol (CID 66617782) is (5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol.
What is the SMILES notation for (5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol?
The canonical SMILES for (5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol is CC1CNCCN1c1ncnc2c1[C@H](C)C[C@H]2O.
What is the InChIKey of (5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol?
The InChIKey is RMKIZTORHJPEIJ-RCAUJQPQSA-N. The full InChI is InChI=1S/C13H20N4O/c1-8-5-10(18)12-11(8)13(16-7-15-12)17-4-3-14-6-9(17)2/h7-10,14,18H,3-6H2,1-2H3/t8-,9?,10-/m1/s1.
What are the key properties of (5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol?
(5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol has a molecular weight of 248.33 g/mol, XLogP of 0.82, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R,7R)-5-methyl-4-(2-methylpiperazin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol is sourced from PubChem (CID 66617782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).