tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate

C20H29N5O2 — CID 153474479

About tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate

tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate (PubChem CID 153474479) has the molecular formula C20H29N5O2 and a molecular weight of 371.49 g/mol. Its IUPAC name is tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate.

Molecular Properties

• Compound Name: tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate
• PubChem CID: 153474479
• Molecular Formula: C20H29N5O2
• Molecular Weight: 371.49 g/mol
• Exact Mass: 371.23
• IUPAC Name: tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate
• SMILES: CC(C)(C)OC(=O)N[C@@H]1CCCC12CCN(c1nccc3nccn13)CC2
• InChI: InChI=1S/C20H29N5O2/c1-19(2,3)27-18(26)23-15-5-4-7-20(15)8-12-24(13-9-20)17-22-10-6-16-21-11-14-25(16)17/h6,10-11,14-15H,4-5,7-9,12-13H2,1-3H3,(H,23,26)/t15-/m1/s1
• InChIKey: LDUFWFHXRJKAMY-OAHLLOKOSA-N
• XLogP: 3.39
• TPSA: 71.76 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 2
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	371.49
LogP ≤ 5	3.39
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate?

The IUPAC name of tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate (CID 153474479) is tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate.

What is the SMILES notation for tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate?

The canonical SMILES for tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate is CC(C)(C)OC(=O)N[C@@H]1CCCC12CCN(c1nccc3nccn13)CC2.

What is the InChIKey of tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate?

The InChIKey is LDUFWFHXRJKAMY-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H29N5O2/c1-19(2,3)27-18(26)23-15-5-4-7-20(15)8-12-24(13-9-20)17-22-10-6-16-21-11-14-25(16)17/h6,10-11,14-15H,4-5,7-9,12-13H2,1-3H3,(H,23,26)/t15-/m1/s1.

What are the key properties of tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate?

tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate has a molecular weight of 371.49 g/mol, XLogP of 3.39, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl N-[(4R)-8-imidazo[1,2-c]pyrimidin-5-yl-8-azaspiro[4.5]decan-4-yl]carbamate is sourced from PubChem (CID 153474479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).