N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide

C20H25N3O3 — CID 97400095

IUPACN-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide
SMILESCC(=O)NCC(=O)N1CCC2(CC1)C(=O)N(CC1CC1)c1ccccc12
InChIInChI=1S/C20H25N3O3/c1-14(24)21-12-18(25)22-10-8-20(9-11-22)16-4-2-3-5-17(16)23(19(20)26)13-15-6-7-15/h2-5,15H,6-13H2,1H3,(H,21,24)
InChIKeyCVRWIHOGDUXFQA-UHFFFAOYSA-N
MW355.44 g/mol
LogP1.44
Rot. Bonds4

About N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide

N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide (PubChem CID 97400095) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide.

Molecular Properties

Compound NameN-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide
PubChem CID97400095
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC NameN-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide
SMILESCC(=O)NCC(=O)N1CCC2(CC1)C(=O)N(CC1CC1)c1ccccc12
InChIInChI=1S/C20H25N3O3/c1-14(24)21-12-18(25)22-10-8-20(9-11-22)16-4-2-3-5-17(16)23(19(20)26)13-15-6-7-15/h2-5,15H,6-13H2,1H3,(H,21,24)
InChIKeyCVRWIHOGDUXFQA-UHFFFAOYSA-N
XLogP1.44
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-N-(2-isopropyl-phenyl)-acetamide
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CID 5703613
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CID 23648349
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CID 9995379

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide?
The IUPAC name of N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide (CID 97400095) is N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide.
What is the SMILES notation for N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide?
The canonical SMILES for N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide is CC(=O)NCC(=O)N1CCC2(CC1)C(=O)N(CC1CC1)c1ccccc12.
What is the InChIKey of N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide?
The InChIKey is CVRWIHOGDUXFQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-14(24)21-12-18(25)22-10-8-20(9-11-22)16-4-2-3-5-17(16)23(19(20)26)13-15-6-7-15/h2-5,15H,6-13H2,1H3,(H,21,24).
What are the key properties of N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide?
N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide has a molecular weight of 355.44 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(cyclopropylmethyl)-2-oxospiro[indole-3,4'-piperidine]-1'-yl]-2-oxoethyl]acetamide is sourced from PubChem (CID 97400095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).