N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide

C22H30N2O — CID 131657389

IUPACN-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
SMILESO=C(CC1CC2(CCN(CC3CC3)CC2)c2ccccc21)NC1CC1
InChIInChI=1S/C22H30N2O/c25-21(23-18-7-8-18)13-17-14-22(20-4-2-1-3-19(17)20)9-11-24(12-10-22)15-16-5-6-16/h1-4,16-18H,5-15H2,(H,23,25)
InChIKeyPPXUGAQIYHBVGU-UHFFFAOYSA-N
MW338.50 g/mol
LogP3.59
Rot. Bonds5

About N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide

N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide (PubChem CID 131657389) has the molecular formula C22H30N2O and a molecular weight of 338.50 g/mol. Its IUPAC name is N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
PubChem CID131657389
Molecular FormulaC22H30N2O
Molecular Weight338.50 g/mol
Exact Mass338.24
IUPAC NameN-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
SMILESO=C(CC1CC2(CCN(CC3CC3)CC2)c2ccccc21)NC1CC1
InChIInChI=1S/C22H30N2O/c25-21(23-18-7-8-18)13-17-14-22(20-4-2-1-3-19(17)20)9-11-24(12-10-22)15-16-5-6-16/h1-4,16-18H,5-15H2,(H,23,25)
InChIKeyPPXUGAQIYHBVGU-UHFFFAOYSA-N
XLogP3.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.50
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide (CID 131657389) is N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide is O=C(CC1CC2(CCN(CC3CC3)CC2)c2ccccc21)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
The InChIKey is PPXUGAQIYHBVGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O/c25-21(23-18-7-8-18)13-17-14-22(20-4-2-1-3-19(17)20)9-11-24(12-10-22)15-16-5-6-16/h1-4,16-18H,5-15H2,(H,23,25).
What are the key properties of N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide has a molecular weight of 338.50 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide is sourced from PubChem (CID 131657389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).