(3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone

C24H23N5O — CID 129186656

IUPAC(3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone
SMILESNC1CCCN(C(=O)c2cccc(-c3cnc4[nH]c(-c5ccccc5)cc4c3)n2)C1
InChIInChI=1S/C24H23N5O/c25-19-8-5-11-29(15-19)24(30)21-10-4-9-20(27-21)18-12-17-13-22(28-23(17)26-14-18)16-6-2-1-3-7-16/h1-4,6-7,9-10,12-14,19H,5,8,11,15,25H2,(H,26,28)
InChIKeyOFRZCUGGICNRRK-UHFFFAOYSA-N
MW397.48 g/mol
LogP3.86
Rot. Bonds3

About (3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone

(3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone (PubChem CID 129186656) has the molecular formula C24H23N5O and a molecular weight of 397.48 g/mol. Its IUPAC name is (3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone.

Molecular Properties

Compound Name(3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone
PubChem CID129186656
Molecular FormulaC24H23N5O
Molecular Weight397.48 g/mol
Exact Mass397.19
IUPAC Name(3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone
SMILESNC1CCCN(C(=O)c2cccc(-c3cnc4[nH]c(-c5ccccc5)cc4c3)n2)C1
InChIInChI=1S/C24H23N5O/c25-19-8-5-11-29(15-19)24(30)21-10-4-9-20(27-21)18-12-17-13-22(28-23(17)26-14-18)16-6-2-1-3-7-16/h1-4,6-7,9-10,12-14,19H,5,8,11,15,25H2,(H,26,28)
InChIKeyOFRZCUGGICNRRK-UHFFFAOYSA-N
XLogP3.86
TPSA87.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.48
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone with MolForge

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Related Compounds

(3-aminopiperidin-1-yl)-pyridin-2-ylmethanone
CID 61295902
(3-aminopiperidin-1-yl)-quinoxalin-2-ylmethanone
CID 103629638
(4-aminopiperidin-1-yl)-[5-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-indol-3-yl]methanone
CID 129186673
[(3R)-3-aminopiperidin-1-yl]-quinolin-2-ylmethanone
CID 102978482
(3-aminopiperidin-1-yl)-(2-methyl-6-phenyl-3-pyridinyl)methanone;dihydrochloride
CID 119379268
(3-aminopiperidin-1-yl)-[5-(1-benzothiophen-5-yl)pyrazin-2-yl]methanone
CID 166300650
(3-aminopiperidin-1-yl)-(4-phenylphenyl)methanone;hydrochloride
CID 119381362
[(3R)-3-aminopyrrolidin-1-yl]-(5-phenyl-1H-pyrrol-2-yl)methanone
CID 119411202
(3-aminopiperidin-1-yl)-(2-pyridin-3-ylquinolin-4-yl)methanone
CID 119380128
3-(3-aminopiperidine-1-carbonyl)-1-phenylpyrazole-5-carboxamide;hydrochloride
CID 119379377
[(3R)-3-aminopiperidin-1-yl]-(5-fluoro-2-pyridinyl)methanone
CID 102983529
2-(3-aminopiperidine-1-carbonyl)benzoic acid
CID 61403703

Frequently Asked Questions

What is the IUPAC name of (3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone?
The IUPAC name of (3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone (CID 129186656) is (3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone.
What is the SMILES notation for (3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone?
The canonical SMILES for (3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone is NC1CCCN(C(=O)c2cccc(-c3cnc4[nH]c(-c5ccccc5)cc4c3)n2)C1.
What is the InChIKey of (3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone?
The InChIKey is OFRZCUGGICNRRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O/c25-19-8-5-11-29(15-19)24(30)21-10-4-9-20(27-21)18-12-17-13-22(28-23(17)26-14-18)16-6-2-1-3-7-16/h1-4,6-7,9-10,12-14,19H,5,8,11,15,25H2,(H,26,28).
What are the key properties of (3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone?
(3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone has a molecular weight of 397.48 g/mol, XLogP of 3.86, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminopiperidin-1-yl)-[6-(2-phenyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]methanone is sourced from PubChem (CID 129186656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).