[(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone

C24H33N7O2 — CID 118915885

About [(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone

[(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone (PubChem CID 118915885) has the molecular formula C24H33N7O2 and a molecular weight of 451.58 g/mol. Its IUPAC name is [(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone.

Molecular Properties

• Compound Name: [(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone
• PubChem CID: 118915885
• Molecular Formula: C24H33N7O2
• Molecular Weight: 451.58 g/mol
• Exact Mass: 451.27
• IUPAC Name: [(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone
• SMILES: O=C([C@H]1CCCN1c1nc2c(c(Nc3cc(C4CCCC4)[nH]n3)n1)CCC2)N1CCOCC1
• InChI: InChI=1S/C24H33N7O2/c32-23(30-11-13-33-14-12-30)20-9-4-10-31(20)24-25-18-8-3-7-17(18)22(27-24)26-21-15-19(28-29-21)16-5-1-2-6-16/h15-16,20H,1-14H2,(H2,25,26,27,28,29)/t20-/m1/s1
• InChIKey: UYLKSKWSHXOTGC-HXUWFJFHSA-N
• XLogP: 2.92
• TPSA: 99.27 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	451.58
LogP ≤ 5	2.92
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone?

The IUPAC name of [(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone (CID 118915885) is [(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone.

What is the SMILES notation for [(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone?

The canonical SMILES for [(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone is O=C([C@H]1CCCN1c1nc2c(c(Nc3cc(C4CCCC4)[nH]n3)n1)CCC2)N1CCOCC1.

What is the InChIKey of [(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone?

The InChIKey is UYLKSKWSHXOTGC-HXUWFJFHSA-N. The full InChI is InChI=1S/C24H33N7O2/c32-23(30-11-13-33-14-12-30)20-9-4-10-31(20)24-25-18-8-3-7-17(18)22(27-24)26-21-15-19(28-29-21)16-5-1-2-6-16/h15-16,20H,1-14H2,(H2,25,26,27,28,29)/t20-/m1/s1.

What are the key properties of [(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone?

[(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone has a molecular weight of 451.58 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for [(2R)-1-[4-[(5-cyclopentyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 118915885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).