1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide

C25H25N5O2 — CID 55886086

IUPAC1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide
SMILESO=C(Nc1cccc(-c2cn3c(n2)CCCC3)c1)C1=NN(Cc2ccccc2)C(=O)CC1
InChIInChI=1S/C25H25N5O2/c31-24-13-12-21(28-30(24)16-18-7-2-1-3-8-18)25(32)26-20-10-6-9-19(15-20)22-17-29-14-5-4-11-23(29)27-22/h1-3,6-10,15,17H,4-5,11-14,16H2,(H,26,32)
InChIKeyMKOLAICMTCOAGQ-UHFFFAOYSA-N
MW427.51 g/mol
LogP4.00
Rot. Bonds5

About 1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide

1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide (PubChem CID 55886086) has the molecular formula C25H25N5O2 and a molecular weight of 427.51 g/mol. Its IUPAC name is 1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide
PubChem CID55886086
Molecular FormulaC25H25N5O2
Molecular Weight427.51 g/mol
Exact Mass427.20
IUPAC Name1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide
SMILESO=C(Nc1cccc(-c2cn3c(n2)CCCC3)c1)C1=NN(Cc2ccccc2)C(=O)CC1
InChIInChI=1S/C25H25N5O2/c31-24-13-12-21(28-30(24)16-18-7-2-1-3-8-18)25(32)26-20-10-6-9-19(15-20)22-17-29-14-5-4-11-23(29)27-22/h1-3,6-10,15,17H,4-5,11-14,16H2,(H,26,32)
InChIKeyMKOLAICMTCOAGQ-UHFFFAOYSA-N
XLogP4.00
TPSA79.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.51
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-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

2,3-dichloro-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 55885167
2,4-dichloro-5-fluoro-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 60525309
3-(2-chlorophenyl)-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide
CID 55885429
1-benzyl-N-[3-(dimethylcarbamoyl)phenyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 55741614
(2S)-2-methylsulfonyl-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]propanamide
CID 94495320
1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 55741600
1-[(4-methoxyphenyl)methyl]-3-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]urea
CID 47075960
N-[5-[[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]carbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 55885300
2,3,4-trimethoxy-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 60525962
3-[methyl(phenyl)sulfamoyl]-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 55885038
3,3-dimethyl-N-[2-oxo-2-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)anilino]ethyl]butanamide
CID 71887416
2-(2-cyanophenyl)sulfanyl-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 60525249

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide?
The IUPAC name of 1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide (CID 55886086) is 1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide.
What is the SMILES notation for 1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide?
The canonical SMILES for 1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide is O=C(Nc1cccc(-c2cn3c(n2)CCCC3)c1)C1=NN(Cc2ccccc2)C(=O)CC1.
What is the InChIKey of 1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide?
The InChIKey is MKOLAICMTCOAGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N5O2/c31-24-13-12-21(28-30(24)16-18-7-2-1-3-8-18)25(32)26-20-10-6-9-19(15-20)22-17-29-14-5-4-11-23(29)27-22/h1-3,6-10,15,17H,4-5,11-14,16H2,(H,26,32).
What are the key properties of 1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide?
1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide has a molecular weight of 427.51 g/mol, XLogP of 4.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-6-oxo-N-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-4,5-dihydropyridazine-3-carboxamide is sourced from PubChem (CID 55886086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).