(1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide

C22H25N3O2 — CID 97400541

IUPAC(1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide
SMILESO=C(NC1CC1)[C@@H]1CC2(CCN(C(=O)c3ccc[nH]3)CC2)c2ccccc21
InChIInChI=1S/C22H25N3O2/c26-20(24-15-7-8-15)17-14-22(18-5-2-1-4-16(17)18)9-12-25(13-10-22)21(27)19-6-3-11-23-19/h1-6,11,15,17,23H,7-10,12-14H2,(H,24,26)/t17-/m1/s1
InChIKeyKFHHIZSEFVGVHG-QGZVFWFLSA-N
MW363.46 g/mol
LogP2.95
Rot. Bonds3

About (1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide

(1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide (PubChem CID 97400541) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is (1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide.

Molecular Properties

Compound Name(1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide
PubChem CID97400541
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC Name(1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide
SMILESO=C(NC1CC1)[C@@H]1CC2(CCN(C(=O)c3ccc[nH]3)CC2)c2ccccc21
InChIInChI=1S/C22H25N3O2/c26-20(24-15-7-8-15)17-14-22(18-5-2-1-4-16(17)18)9-12-25(13-10-22)21(27)19-6-3-11-23-19/h1-6,11,15,17,23H,7-10,12-14H2,(H,24,26)/t17-/m1/s1
InChIKeyKFHHIZSEFVGVHG-QGZVFWFLSA-N
XLogP2.95
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide with MolForge

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Related Compounds

(1-ethoxyspiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-yl)-(1H-pyrrol-2-yl)methanone
CID 134073257
N-methyl-1'-(thiadiazole-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide
CID 118739062
N-methyl-1'-(pyrazine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide
CID 131640770
(1S)-1-[2-(cyclopropylamino)-2-oxoethyl]-N,N-dimethylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide
CID 97376139
N-cyclopropyl-2-[(1S)-1'-(thiophene-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 97376130
N-cyclopentyl-1'-pyrazin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide;2,2,2-trifluoroacetic acid
CID 155857325
N-cyclopropyl-2-[1'-(pyridine-3-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 131662358
N-cyclopropyl-2-[(1R)-1'-(6-methylpyridine-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 97376126
1-[2-(cyclobutylamino)-2-oxoethyl]-N,N-dimethylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxamide
CID 131661630
N-cyclobutyl-2-[(1R)-1'-(2-methylfuran-3-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 97375898
N-cyclobutyl-2-[1'-(pyridazine-4-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 131655149
N-cyclopropyl-2-[1'-(cyclopropylmethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 131657389

Frequently Asked Questions

What is the IUPAC name of (1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide?
The IUPAC name of (1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide (CID 97400541) is (1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide.
What is the SMILES notation for (1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide?
The canonical SMILES for (1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide is O=C(NC1CC1)[C@@H]1CC2(CCN(C(=O)c3ccc[nH]3)CC2)c2ccccc21.
What is the InChIKey of (1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide?
The InChIKey is KFHHIZSEFVGVHG-QGZVFWFLSA-N. The full InChI is InChI=1S/C22H25N3O2/c26-20(24-15-7-8-15)17-14-22(18-5-2-1-4-16(17)18)9-12-25(13-10-22)21(27)19-6-3-11-23-19/h1-6,11,15,17,23H,7-10,12-14H2,(H,24,26)/t17-/m1/s1.
What are the key properties of (1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide?
(1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide has a molecular weight of 363.46 g/mol, XLogP of 2.95, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-cyclopropyl-1'-(1H-pyrrole-2-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide is sourced from PubChem (CID 97400541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).