(2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide

C23H26N8O2 — CID 90234525

About (2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide

(2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide (PubChem CID 90234525) has the molecular formula C23H26N8O2 and a molecular weight of 446.52 g/mol. Its IUPAC name is (2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide.

Molecular Properties

• Compound Name: (2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide
• PubChem CID: 90234525
• Molecular Formula: C23H26N8O2
• Molecular Weight: 446.52 g/mol
• Exact Mass: 446.22
• IUPAC Name: (2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide
• SMILES: O=C(Nc1cccnc1)[C@H]1C[C@@H](O)CN1c1nc2c(c(Nc3cc(C4CC4)[nH]n3)n1)CCC2
• InChI: InChI=1S/C23H26N8O2/c32-15-9-19(22(33)25-14-3-2-8-24-11-14)31(12-15)23-26-17-5-1-4-16(17)21(28-23)27-20-10-18(29-30-20)13-6-7-13/h2-3,8,10-11,13,15,19,32H,1,4-7,9,12H2,(H,25,33)(H2,26,27,28,29,30)/t15-,19-/m1/s1
• InChIKey: WUXNMYKVCJGVFF-DNVCBOLYSA-N
• XLogP: 2.28
• TPSA: 131.95 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 8
• Rotatable Bonds: 6
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	446.52
LogP ≤ 5	2.28
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of (2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide?

The IUPAC name of (2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide (CID 90234525) is (2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide.

What is the SMILES notation for (2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide?

The canonical SMILES for (2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide is O=C(Nc1cccnc1)[C@H]1C[C@@H](O)CN1c1nc2c(c(Nc3cc(C4CC4)[nH]n3)n1)CCC2.

What is the InChIKey of (2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide?

The InChIKey is WUXNMYKVCJGVFF-DNVCBOLYSA-N. The full InChI is InChI=1S/C23H26N8O2/c32-15-9-19(22(33)25-14-3-2-8-24-11-14)31(12-15)23-26-17-5-1-4-16(17)21(28-23)27-20-10-18(29-30-20)13-6-7-13/h2-3,8,10-11,13,15,19,32H,1,4-7,9,12H2,(H,25,33)(H2,26,27,28,29,30)/t15-,19-/m1/s1.

What are the key properties of (2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide?

(2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide has a molecular weight of 446.52 g/mol, XLogP of 2.28, 6 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,4R)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]-4-hydroxy-N-pyridin-3-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 90234525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).