spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide

C12H16N4O — CID 154467450

IUPACspiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide
SMILESNC(=O)N1CC2(CCNCC2)c2ccncc21
InChIInChI=1S/C12H16N4O/c13-11(17)16-8-12(2-5-14-6-3-12)9-1-4-15-7-10(9)16/h1,4,7,14H,2-3,5-6,8H2,(H2,13,17)
InChIKeyXKXDFFWGQSRCSO-UHFFFAOYSA-N
MW232.29 g/mol
LogP0.60
Rot. Bonds

About spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide

spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide (PubChem CID 154467450) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide.

Molecular Properties

Compound Namespiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide
PubChem CID154467450
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC Namespiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide
SMILESNC(=O)N1CC2(CCNCC2)c2ccncc21
InChIInChI=1S/C12H16N4O/c13-11(17)16-8-12(2-5-14-6-3-12)9-1-4-15-7-10(9)16/h1,4,7,14H,2-3,5-6,8H2,(H2,13,17)
InChIKeyXKXDFFWGQSRCSO-UHFFFAOYSA-N
XLogP0.60
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-1-spiro[2H-indole-3,4'-piperidine]-1-ylpropan-1-one
CID 57041656
N,N-dimethylspiro[2H-pyrrolo[2,3-b]pyridine-3,4'-piperidine]-1-carboxamide
CID 162343027
1-(pyridin-3-ylmethyl)-3-(4-spiro[2H-indole-3,4'-piperidine]-1-ylphenyl)urea
CID 71164987
cyclopropyl-(5-fluorospiro[2H-indole-3,4'-piperidine]-1-yl)methanone;2,2,2-trifluoroacetic acid
CID 118742218
2-spiro[1,3-dihydroisoquinoline-4,4'-piperidine]-2-ylacetamide;hydrochloride
CID 155857534
benzyl 5-bromospiro[2H-indole-3,4'-piperidine]-1-carboxylate
CID 133056068
(2-chloro-4-pyridinyl)-spiro[2H-pyrrolo[2,3-b]pyridine-3,4'-piperidine]-1-ylmethanone
CID 87321323
[(3S)-3-(3-amino-4-pyridinyl)piperidin-3-yl] carbamate
CID 90281048
1,5-dimethylspiro[2H-indole-3,4'-piperidine]
CID 59466294
2-oxospiro[1H-pyrrolo[2,3-c]pyridine-3,3'-azetidine]-1'-carboxylic acid
CID 122610682
(4-amino-3-pyridinyl)-(4-phenylpiperidin-4-yl)methanone
CID 116561844
2-(trifluoromethyl)-2,3-dihydropyrido[4,3-b][1,4]oxazine-4-carboxamide
CID 176549428

Frequently Asked Questions

What is the IUPAC name of spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide?
The IUPAC name of spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide (CID 154467450) is spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide.
What is the SMILES notation for spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide?
The canonical SMILES for spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide is NC(=O)N1CC2(CCNCC2)c2ccncc21.
What is the InChIKey of spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide?
The InChIKey is XKXDFFWGQSRCSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c13-11(17)16-8-12(2-5-14-6-3-12)9-1-4-15-7-10(9)16/h1,4,7,14H,2-3,5-6,8H2,(H2,13,17).
What are the key properties of spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide?
spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide has a molecular weight of 232.29 g/mol, XLogP of 0.60, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[2H-pyrrolo[2,3-c]pyridine-3,4'-piperidine]-1-carboxamide is sourced from PubChem (CID 154467450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).