1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide

C24H23N5O — CID 70036441

IUPAC1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1n[nH]c2cc(-c3ccccc3)ncc12)C1CCN(Cc2ccccc2)C1
InChIInChI=1S/C24H23N5O/c30-24(19-11-12-29(16-19)15-17-7-3-1-4-8-17)26-23-20-14-25-21(13-22(20)27-28-23)18-9-5-2-6-10-18/h1-10,13-14,19H,11-12,15-16H2,(H2,26,27,28,30)
InChIKeyXXKXKMUXVVFQIQ-UHFFFAOYSA-N
MW397.48 g/mol
LogP4.09
Rot. Bonds5

About 1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide

1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide (PubChem CID 70036441) has the molecular formula C24H23N5O and a molecular weight of 397.48 g/mol. Its IUPAC name is 1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide
PubChem CID70036441
Molecular FormulaC24H23N5O
Molecular Weight397.48 g/mol
Exact Mass397.19
IUPAC Name1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1n[nH]c2cc(-c3ccccc3)ncc12)C1CCN(Cc2ccccc2)C1
InChIInChI=1S/C24H23N5O/c30-24(19-11-12-29(16-19)15-17-7-3-1-4-8-17)26-23-20-14-25-21(13-22(20)27-28-23)18-9-5-2-6-10-18/h1-10,13-14,19H,11-12,15-16H2,(H2,26,27,28,30)
InChIKeyXXKXKMUXVVFQIQ-UHFFFAOYSA-N
XLogP4.09
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.48
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)cyclopropanecarboxamide
CID 10214741
(3R)-1-benzyl-N-[5-bromo-6-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrrolidine-3-carboxamide
CID 101338283
1-benzyl-N-[4-(1H-1,2,4-triazol-5-yl)phenyl]pyrrolidine-3-carboxamide
CID 136545193
1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide
CID 48508171
(1-benzylpyrrolidin-3-yl)-pyrrolidin-1-ylmethanone
CID 67294243
1-benzyl-N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]piperidine-4-carboxamide
CID 67455298
1-benzyl-N-(5-chloro-2-pyridinyl)piperidine-3-carboxamide
CID 60565468
1-[(3S)-1-benzylpyrrolidin-3-yl]-2-chloroethanone
CID 164769335
1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide
CID 43925060
1-benzyl-N-(1,3-thiazol-2-yl)piperidine-3-carboxamide
CID 60548570
(3S)-1-benzyl-N-[(3-propan-2-yl-1H-1,2,4-triazol-5-yl)methyl]pyrrolidine-3-carboxamide
CID 164638213
(3R)-1-benzyl-N-[3-(difluoromethyl)-5-methyl-1H-pyrazol-4-yl]piperidine-3-carboxamide
CID 124882392

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide?
The IUPAC name of 1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide (CID 70036441) is 1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide?
The canonical SMILES for 1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide is O=C(Nc1n[nH]c2cc(-c3ccccc3)ncc12)C1CCN(Cc2ccccc2)C1.
What is the InChIKey of 1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide?
The InChIKey is XXKXKMUXVVFQIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O/c30-24(19-11-12-29(16-19)15-17-7-3-1-4-8-17)26-23-20-14-25-21(13-22(20)27-28-23)18-9-5-2-6-10-18/h1-10,13-14,19H,11-12,15-16H2,(H2,26,27,28,30).
What are the key properties of 1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide?
1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide has a molecular weight of 397.48 g/mol, XLogP of 4.09, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(6-phenyl-1H-pyrazolo[4,3-c]pyridin-3-yl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 70036441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).