6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide

C23H24N4O2 — CID 95682618

IUPAC6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)NCCN2c3ccccc3C[C@@H]2C)nn1-c1ccccc1
InChIInChI=1S/C23H24N4O2/c1-16-14-18-8-6-7-11-20(18)26(16)13-12-24-23(29)22-21(28)15-17(2)27(25-22)19-9-4-3-5-10-19/h3-11,15-16H,12-14H2,1-2H3,(H,24,29)/t16-/m0/s1
InChIKeyHUAOVLJRSJNZSG-INIZCTEOSA-N
MW388.47 g/mol
LogP2.72
Rot. Bonds5

About 6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide

6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide (PubChem CID 95682618) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is 6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide
PubChem CID95682618
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Name6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)NCCN2c3ccccc3C[C@@H]2C)nn1-c1ccccc1
InChIInChI=1S/C23H24N4O2/c1-16-14-18-8-6-7-11-20(18)26(16)13-12-24-23(29)22-21(28)15-17(2)27(25-22)19-9-4-3-5-10-19/h3-11,15-16H,12-14H2,1-2H3,(H,24,29)/t16-/m0/s1
InChIKeyHUAOVLJRSJNZSG-INIZCTEOSA-N
XLogP2.72
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide with MolForge

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Related Compounds

6-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]-4-oxo-1-phenylpyridazine-3-carboxamide
CID 35417792
N-(3-aminopropyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide;hydrochloride
CID 119406647
6-methyl-4-oxo-1-phenyl-N-[3-(4-phenylpiperazin-1-yl)propyl]pyridazine-3-carboxamide
CID 38447789
N-(cyclopentylmethyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 43067725
1-methyl-N-[2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-2-oxopyridine-4-carboxamide
CID 95235616
6-methyl-N-(4-methylpiperazin-1-yl)-4-oxo-1-phenylpyridazine-3-carboxamide
CID 9075242
N-cyclohexyl-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 51237420
N-[2-(furan-2-yl)ethyl]-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 17448047
N-[2-(ethylamino)-2-oxoethyl]-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 86909633
N-[(1,5-dimethylpyrrol-2-yl)methyl]-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 31218833
N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]-3,5-dinitrobenzamide
CID 60599573
N-[3-(N-ethylanilino)propyl]-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 41278411

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide?
The IUPAC name of 6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide (CID 95682618) is 6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide?
The canonical SMILES for 6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide is Cc1cc(=O)c(C(=O)NCCN2c3ccccc3C[C@@H]2C)nn1-c1ccccc1.
What is the InChIKey of 6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide?
The InChIKey is HUAOVLJRSJNZSG-INIZCTEOSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-16-14-18-8-6-7-11-20(18)26(16)13-12-24-23(29)22-21(28)15-17(2)27(25-22)19-9-4-3-5-10-19/h3-11,15-16H,12-14H2,1-2H3,(H,24,29)/t16-/m0/s1.
What are the key properties of 6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide?
6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide has a molecular weight of 388.47 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethyl]-4-oxo-1-phenylpyridazine-3-carboxamide is sourced from PubChem (CID 95682618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).