N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide

C25H23N5O2 — CID 68749119

IUPACN-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(C2=CCN(C(=O)c3ccccc3)CC2)nc1)N1Cc2ccncc2C1
InChIInChI=1S/C25H23N5O2/c31-24(19-4-2-1-3-5-19)29-12-9-18(10-13-29)23-7-6-22(15-27-23)28-25(32)30-16-20-8-11-26-14-21(20)17-30/h1-9,11,14-15H,10,12-13,16-17H2,(H,28,32)
InChIKeyBHNUAGUGBQKFQX-UHFFFAOYSA-N
MW425.49 g/mol
LogP3.95
Rot. Bonds3

About N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide

N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide (PubChem CID 68749119) has the molecular formula C25H23N5O2 and a molecular weight of 425.49 g/mol. Its IUPAC name is N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide
PubChem CID68749119
Molecular FormulaC25H23N5O2
Molecular Weight425.49 g/mol
Exact Mass425.19
IUPAC NameN-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(C2=CCN(C(=O)c3ccccc3)CC2)nc1)N1Cc2ccncc2C1
InChIInChI=1S/C25H23N5O2/c31-24(19-4-2-1-3-5-19)29-12-9-18(10-13-29)23-7-6-22(15-27-23)28-25(32)30-16-20-8-11-26-14-21(20)17-30/h1-9,11,14-15H,10,12-13,16-17H2,(H,28,32)
InChIKeyBHNUAGUGBQKFQX-UHFFFAOYSA-N
XLogP3.95
TPSA78.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.49
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl 4-[4-(1,3-dihydropyrrolo[3,4-c]pyridine-2-carbonylamino)phenyl]-3,6-dihydro-2H-pyridine-1-carboxylate
CID 68751289
N-[4-[1-(1,1-dihydroxythiane-4-carbonyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide
CID 68751511
N-(4-propylphenyl)-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 11301714
N-[4-[(2-methylpropan-2-yl)oxy]phenyl]-4-pyrazin-2-yl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 11348741
N-[4-[2-(2-methylpropanoyl)-1,2,3,6-tetrahydropyridin-4-yl]phenyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide
CID 123547495
N-[5-[1-(2-hydroxy-2-methylpropanoyl)-3,6-dihydro-2H-pyridin-4-yl]-2-pyridinyl]-1,3-dihydroisoindole-2-carboxamide
CID 68753181
N-(4-fluorophenyl)-3-phenyl-2,5-dihydropyrrole-1-carboxamide
CID 75401002
(2-fluoro-4-pyridinyl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone
CID 61292889
N-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]benzamide
CID 17018926
N-[4-[1-(furan-2-carbonyl)piperidin-4-yl]phenyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide
CID 68751029
1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxylic acid
CID 70298900
N-(6-chloro-3-pyridinyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxamide
CID 10214947

Frequently Asked Questions

What is the IUPAC name of N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide?
The IUPAC name of N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide (CID 68749119) is N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide.
What is the SMILES notation for N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide?
The canonical SMILES for N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide is O=C(Nc1ccc(C2=CCN(C(=O)c3ccccc3)CC2)nc1)N1Cc2ccncc2C1.
What is the InChIKey of N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide?
The InChIKey is BHNUAGUGBQKFQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N5O2/c31-24(19-4-2-1-3-5-19)29-12-9-18(10-13-29)23-7-6-22(15-27-23)28-25(32)30-16-20-8-11-26-14-21(20)17-30/h1-9,11,14-15H,10,12-13,16-17H2,(H,28,32).
What are the key properties of N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide?
N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide has a molecular weight of 425.49 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(1-benzoyl-3,6-dihydro-2H-pyridin-4-yl)-3-pyridinyl]-1,3-dihydropyrrolo[3,4-c]pyridine-2-carboxamide is sourced from PubChem (CID 68749119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).