[(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate

C24H30FN7O3 — CID 169141977

About [(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate

[(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate (PubChem CID 169141977) has the molecular formula C24H30FN7O3 and a molecular weight of 483.55 g/mol. Its IUPAC name is [(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate.

Molecular Properties

• Compound Name: [(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate
• PubChem CID: 169141977
• Molecular Formula: C24H30FN7O3
• Molecular Weight: 483.55 g/mol
• Exact Mass: 483.24
• IUPAC Name: [(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate
• SMILES: COCc1cn2c(Nc3cc([C@H]4C[C@@H](F)[C@@H](OC(=O)NC5(C)CC5)C4)[nH]n3)nc(C3CC3)cc2n1
• InChI: InChI=1S/C24H30FN7O3/c1-24(5-6-24)29-23(33)35-19-8-14(7-16(19)25)18-9-20(31-30-18)28-22-27-17(13-3-4-13)10-21-26-15(12-34-2)11-32(21)22/h9-11,13-14,16,19H,3-8,12H2,1-2H3,(H,29,33)(H2,27,28,30,31)/t14-,16+,19-/m0/s1
• InChIKey: DOYWDPHYHRBKFU-GMBSWORKSA-N
• XLogP: 4.08
• TPSA: 118.46 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 8
• Rotatable Bonds: 8
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	483.55
LogP ≤ 5	4.08
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of [(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate?

The IUPAC name of [(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate (CID 169141977) is [(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate.

What is the SMILES notation for [(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate?

The canonical SMILES for [(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate is COCc1cn2c(Nc3cc([C@H]4C[C@@H](F)[C@@H](OC(=O)NC5(C)CC5)C4)[nH]n3)nc(C3CC3)cc2n1.

What is the InChIKey of [(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate?

The InChIKey is DOYWDPHYHRBKFU-GMBSWORKSA-N. The full InChI is InChI=1S/C24H30FN7O3/c1-24(5-6-24)29-23(33)35-19-8-14(7-16(19)25)18-9-20(31-30-18)28-22-27-17(13-3-4-13)10-21-26-15(12-34-2)11-32(21)22/h9-11,13-14,16,19H,3-8,12H2,1-2H3,(H,29,33)(H2,27,28,30,31)/t14-,16+,19-/m0/s1.

What are the key properties of [(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate?

[(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate has a molecular weight of 483.55 g/mol, XLogP of 4.08, 8 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for [(1S,2R,4R)-4-[3-[[7-cyclopropyl-2-(methoxymethyl)imidazo[1,2-c]pyrimidin-5-yl]amino]-1H-pyrazol-5-yl]-2-fluorocyclopentyl] N-(1-methylcyclopropyl)carbamate is sourced from PubChem (CID 169141977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).