N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide

C20H22N4O2 — CID 131640770

IUPACN-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide
SMILESCNC(=O)C1CC2(CCN(C(=O)c3cnccn3)CC2)c2ccccc21
InChIInChI=1S/C20H22N4O2/c1-21-18(25)15-12-20(16-5-3-2-4-14(15)16)6-10-24(11-7-20)19(26)17-13-22-8-9-23-17/h2-5,8-9,13,15H,6-7,10-12H2,1H3,(H,21,25)
InChIKeyNKSGFYDYIYQZLH-UHFFFAOYSA-N
MW350.42 g/mol
LogP1.88
Rot. Bonds2

About N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide

N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide (PubChem CID 131640770) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide.

Molecular Properties

Compound NameN-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide
PubChem CID131640770
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC NameN-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide
SMILESCNC(=O)C1CC2(CCN(C(=O)c3cnccn3)CC2)c2ccccc21
InChIInChI=1S/C20H22N4O2/c1-21-18(25)15-12-20(16-5-3-2-4-14(15)16)6-10-24(11-7-20)19(26)17-13-22-8-9-23-17/h2-5,8-9,13,15H,6-7,10-12H2,1H3,(H,21,25)
InChIKeyNKSGFYDYIYQZLH-UHFFFAOYSA-N
XLogP1.88
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1'-(thiadiazole-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide
CID 118739062
1-(4-methylpiperazin-1-yl)-2-[(1R)-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]ethanone
CID 97376073
1-(4-methylpiperazin-1-yl)-2-[(1S)-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]ethanone
CID 97376072
N-(cyclopropylmethyl)-2-[1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 131651674
(1R)-N-methyl-1'-[(1-methylpyrazol-4-yl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide
CID 97400469
[4-methyl-4-(methylamino)piperidin-1-yl]-pyrazin-2-ylmethanone
CID 115304614
N-[(1R,2R)-2-phenylmethoxy-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 42274264
(3S)-1-methyl-3-phenyl-8-(pyrazine-2-carbonyl)-1,8-diazaspiro[4.5]decan-2-one
CID 97469506
pyrazin-2-yl-(2-pyridin-3-yloxy-7-azaspiro[3.5]nonan-7-yl)methanone
CID 97451301
N-cyclopentyl-1'-pyrazin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide;2,2,2-trifluoroacetic acid
CID 155857325
(1S)-1'-[5-[(2-aminophenyl)carbamoyl]-2-pyridinyl]-N-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide
CID 25009484
1-[7-(pyrazine-2-carbonyl)-1,7-diazaspiro[3.5]nonan-1-yl]ethanone
CID 97412790

Frequently Asked Questions

What is the IUPAC name of N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide?
The IUPAC name of N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide (CID 131640770) is N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide.
What is the SMILES notation for N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide?
The canonical SMILES for N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide is CNC(=O)C1CC2(CCN(C(=O)c3cnccn3)CC2)c2ccccc21.
What is the InChIKey of N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide?
The InChIKey is NKSGFYDYIYQZLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-21-18(25)15-12-20(16-5-3-2-4-14(15)16)6-10-24(11-7-20)19(26)17-13-22-8-9-23-17/h2-5,8-9,13,15H,6-7,10-12H2,1H3,(H,21,25).
What are the key properties of N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide?
N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide has a molecular weight of 350.42 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide is sourced from PubChem (CID 131640770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).