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

C16H26N4O — CID 68735699

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

(7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol (PubChem CID 68735699) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is (7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol.

Molecular Properties

• Compound Name: (7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol
• PubChem CID: 68735699
• Molecular Formula: C16H26N4O
• Molecular Weight: 290.41 g/mol
• Exact Mass: 290.21
• IUPAC Name: (7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol
• SMILES: CC1C[C@@H](O)c2ncnc(N3CCN(C(C)(C)C)CC3)c21
• InChI: InChI=1S/C16H26N4O/c1-11-9-12(21)14-13(11)15(18-10-17-14)19-5-7-20(8-6-19)16(2,3)4/h10-12,21H,5-9H2,1-4H3/t11?,12-/m1/s1
• InChIKey: UPFVOORJFMHEPE-PIJUOVFKSA-N
• XLogP: 1.94
• TPSA: 52.49 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 1
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	290.41
LogP ≤ 5	1.94
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of (7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol?

The IUPAC name of (7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol (CID 68735699) is (7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol.

What is the SMILES notation for (7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol?

The canonical SMILES for (7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol is CC1C[C@@H](O)c2ncnc(N3CCN(C(C)(C)C)CC3)c21.

What is the InChIKey of (7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol?

The InChIKey is UPFVOORJFMHEPE-PIJUOVFKSA-N. The full InChI is InChI=1S/C16H26N4O/c1-11-9-12(21)14-13(11)15(18-10-17-14)19-5-7-20(8-6-19)16(2,3)4/h10-12,21H,5-9H2,1-4H3/t11?,12-/m1/s1.

What are the key properties of (7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol?

(7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol has a molecular weight of 290.41 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for (7R)-4-(4-tert-butylpiperazin-1-yl)-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-ol is sourced from PubChem (CID 68735699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).