6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide

C19H24N4O2 — CID 43065015

IUPAC6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide
SMILESCCCn1nc(C(=O)NCC2CCN(c3ccccc3)C2)ccc1=O
InChIInChI=1S/C19H24N4O2/c1-2-11-23-18(24)9-8-17(21-23)19(25)20-13-15-10-12-22(14-15)16-6-4-3-5-7-16/h3-9,15H,2,10-14H2,1H3,(H,20,25)
InChIKeyJEQAQZMNGZZJMU-UHFFFAOYSA-N
MW340.43 g/mol
LogP1.91
Rot. Bonds6

About 6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide

6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide (PubChem CID 43065015) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide
PubChem CID43065015
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide
SMILESCCCn1nc(C(=O)NCC2CCN(c3ccccc3)C2)ccc1=O
InChIInChI=1S/C19H24N4O2/c1-2-11-23-18(24)9-8-17(21-23)19(25)20-13-15-10-12-22(14-15)16-6-4-3-5-7-16/h3-9,15H,2,10-14H2,1H3,(H,20,25)
InChIKeyJEQAQZMNGZZJMU-UHFFFAOYSA-N
XLogP1.91
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-oxo-N-[4-(4-phenylpiperazin-1-yl)butyl]-1-propylpyridazine-3-carboxamide
CID 55859833
6-oxo-N-[[(3S)-1-phenylpyrrolidin-3-yl]methyl]-1H-pyridazine-3-carboxamide
CID 38442945
1-butyl-N-[[1-(5-chloro-2-methylphenyl)pyrrolidin-3-yl]methyl]-6-oxopyridazine-3-carboxamide
CID 51134400
1-phenyl-N-[(1-phenylpyrrolidin-3-yl)methyl]triazole-4-carboxamide
CID 43071245
N-[[(3S)-1-phenylpyrrolidin-3-yl]methyl]pyrazine-2-carboxamide
CID 35220191
1-methyl-3-[(1-phenylpyrrolidin-3-yl)methyl]urea
CID 20827758
2-chloro-N-[(1-phenylpyrrolidin-3-yl)methyl]benzamide
CID 42957578
ethyl N-[(1-phenylpyrrolidin-3-yl)methyl]carbamate
CID 110640322
2-[(6-oxo-1-propylpyridazine-3-carbonyl)amino]pentanoic acid
CID 43630891
6-(dimethylamino)-N-[[(3R)-1-phenylpyrrolidin-3-yl]methyl]pyridine-3-carboxamide
CID 38441786
4-methoxy-1-phenyl-N-[(1-phenylpyrrolidin-3-yl)methyl]pyrazole-3-carboxamide
CID 55621665
2-hydroxy-4-[(6-oxo-1-propylpyridazine-3-carbonyl)amino]butanoic acid
CID 107831909

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide?
The IUPAC name of 6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide (CID 43065015) is 6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide?
The canonical SMILES for 6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide is CCCn1nc(C(=O)NCC2CCN(c3ccccc3)C2)ccc1=O.
What is the InChIKey of 6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide?
The InChIKey is JEQAQZMNGZZJMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-2-11-23-18(24)9-8-17(21-23)19(25)20-13-15-10-12-22(14-15)16-6-4-3-5-7-16/h3-9,15H,2,10-14H2,1H3,(H,20,25).
What are the key properties of 6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide?
6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 1.91, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-1-propylpyridazine-3-carboxamide is sourced from PubChem (CID 43065015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).