2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide

C22H27N5O — CID 68735066

IUPAC2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide
SMILESCC1CCc2ncnc(N3CC4(CCNCC4)c4cc(CC(N)=O)ccc43)c21
InChIInChI=1S/C22H27N5O/c1-14-2-4-17-20(14)21(26-13-25-17)27-12-22(6-8-24-9-7-22)16-10-15(11-19(23)28)3-5-18(16)27/h3,5,10,13-14,24H,2,4,6-9,11-12H2,1H3,(H2,23,28)
InChIKeyMPOPBAKMAMFJBU-UHFFFAOYSA-N
MW377.49 g/mol
LogP2.33
Rot. Bonds3

About 2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide

2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide (PubChem CID 68735066) has the molecular formula C22H27N5O and a molecular weight of 377.49 g/mol. Its IUPAC name is 2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide.

Molecular Properties

Compound Name2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide
PubChem CID68735066
Molecular FormulaC22H27N5O
Molecular Weight377.49 g/mol
Exact Mass377.22
IUPAC Name2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide
SMILESCC1CCc2ncnc(N3CC4(CCNCC4)c4cc(CC(N)=O)ccc43)c21
InChIInChI=1S/C22H27N5O/c1-14-2-4-17-20(14)21(26-13-25-17)27-12-22(6-8-24-9-7-22)16-10-15(11-19(23)28)3-5-18(16)27/h3,5,10,13-14,24H,2,4,6-9,11-12H2,1H3,(H2,23,28)
InChIKeyMPOPBAKMAMFJBU-UHFFFAOYSA-N
XLogP2.33
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.49
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide?
The IUPAC name of 2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide (CID 68735066) is 2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide.
What is the SMILES notation for 2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide?
The canonical SMILES for 2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide is CC1CCc2ncnc(N3CC4(CCNCC4)c4cc(CC(N)=O)ccc43)c21.
What is the InChIKey of 2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide?
The InChIKey is MPOPBAKMAMFJBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N5O/c1-14-2-4-17-20(14)21(26-13-25-17)27-12-22(6-8-24-9-7-22)16-10-15(11-19(23)28)3-5-18(16)27/h3,5,10,13-14,24H,2,4,6-9,11-12H2,1H3,(H2,23,28).
What are the key properties of 2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide?
2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide has a molecular weight of 377.49 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-yl]acetamide is sourced from PubChem (CID 68735066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).